Refractive Index and Dispersion of Fluorides and Oxides
Transcrição
Refractive Index and Dispersion of Fluorides and Oxides
Refractive Index and Dispersion of Fluorides and Oxides Robert D. Shannona… Geological Sciences/CIRES, University of Colorado, Boulder, Colorado 80309 Ruth C. Shannon 118 Left Fork Road, Boulder, Colorado 80302 Olaf Medenbachb… Institut für Mineralogie, Fakultät fur Geowissenschaften, Ruhr-Universität Bochum, Universitätsstraße 150, D-44780 Bochum, Germany Reinhard X. Fischerc… Fachbereich Geowissenschaften, Universität Bremen, Klagenfurter Straße, D-28359 Bremen, Germany 共Received 19 September 2001; accepted 13 May 2002; published 25 October 2002兲 The refractive indices of 509 oxides and 55 fluorides were analyzed using two forms of a one-term Sellmeier equation: 共1兲 1/(n 2 ⫺1)⫽⫺A/ 2 ⫹B, where A, the slope of the plot of (n 2 ⫺1) ⫺1 versus ⫺2 in units of 10⫺16 m2 , gives a measure of dispersion and B, the intercept of the plot at ⫽⬁, gives n ⬁ ⫽(1⫹1/B) 1/2 and 共2兲 n 2 ⫺1⫽E dE o /(E 2o ⫺(ប ) 2 ), where ប ⫽the photon energy, E o⫽the average single oscillator 共Sellmeier兲 energy gap, and E d⫽the average oscillator strength, which measures the strength of interband optical transitions. Form 共1兲 was used to calculate n at ⫽589.3 nm (n D) and n at ⫽⬁ (n ⬁ ), and the dispersion constant A. The total mean polarizabilility for each compound was calculated using the Lorenz–Lorentz equation: ␣ e⫽3/4 关 (V m) (n ⬁2 ⫺1)/(n ⬁2 ⫹2)], where V m is the molar volume in Å 3 . Provided for each compound are: n D , n ⬁ , V m , 具 ␣ e典 , 具 A 典 , 具 B 典 , 具 E d典 , 具 E o典 , the literature reference, the method of measurement of n and estimated errors in n. Results obtained by prism, infrared reflectivity, ellipsometry, and interference methods are compared. Consistency of dispersion values among like compounds and structural families is used to evaluate the accuracy of refractive index data. Dispersion values range from 40 to 260⫻10⫺16 m2 with the majority of values in the range of 60– 100⫻10⫺16 m2 . High dispersion is associated with s 2 , p 6 , d 10, and transition metal ions, H2 O, and crystalline hydrates, whereas normal dispersion values are found in borates, aluminates, gallates, silicates, germanates, phosphates, and sulfates not containing H2 O or any of the above ions. Exceptionally high dispersion is observed in liquid H2 O, Fe2 O3 , Y3 Fe5 O12 , FeOOH, Fe2 (SO4 ) 3 , UO2 , Cu2 O, V2 O5 , MgCrO4 •7H2 O, and Cs2 Mg共CrO4 ) 2 •6H2 O. © 2002 American Institute of Physics. 关DOI: 10.1063/1.1497384兴 Key words: ellipsometry; infrared reflectivity; interband optical transitions; interference method; optical dispersion; oscillator strength; prism method; refractive index; Sellmeier equation; single oscillator energy gap 2.4. Error Limits. . . . . . . . . . . . . . . . . . . . . . . . . . . . 3. Results and Discussion. . . . . . . . . . . . . . . . . . . . . . . 3.1. Comparison of Data Using Different Methods. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 3.2. Comparison of Dispersion Values. . . . . . . . . . 3.3. Analysis of Dispersion Values. . . . . . . . . . . . . 3.3.1. Transition Metal Ions. . . . . . . . . . . . . . . 3.3.2. d 10 Ions. . . . . . . . . . . . . . . . . . . . . . . . . . 3.3.3. p 6 Ions. . . . . . . . . . . . . . . . . . . . . . . . . . 3.3.4. s 2 Ions. . . . . . . . . . . . . . . . . . . . . . . . . . . 3.3.5. H2 O and Hydrates. . . . . . . . . . . . . . . . . 3.3.6. Summary of Effect of Electron Configuration and E o and E d on Contents 1. Introduction. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2. Presentation of Data. . . . . . . . . . . . . . . . . . . . . . . . . 2.1. Composition, Characterization, and Source... 2.2. Method of Measuring Dispersion or n ⬁ . . . . . 2.3. Sellmeier Analysis. . . . . . . . . . . . . . . . . . . . . . . 932 932 932 933 933 a兲 Electronic mail: [email protected] Electronic mail: [email protected] c兲 Author to whom correspondence should be addressed; electronic mail: [email protected] © 2002 American Institute of Physics. b兲 0047-2689Õ2002Õ31„4…Õ931Õ40Õ$35.00 931 959 960 960 961 963 964 965 966 967 967 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 932 4. 5. 6. 7. 8. Dispersion. . . . . . . . . . . . . . . . . . . . . . . . Acknowledgments. . . . . . . . . . . . . . . . . . . . . . . . . . References. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . References for Tables 1 and 3. . . . . . . . . . . . . . . . . Appendix 1. List of Codens. . . . . . . . . . . . . . . . . . . Appendix 2. Alternative Forms of the Sellmeier Equation. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . List of Tables 1. Refractive index and dispersion data. . . . . . . . . . . . 2. Comparison of n ⬁ values determined by prism methods and reflectivity methods. . . . . . . . . . . . . . 3. Inconsistent dispersion values. . . . . . . . . . . . . . . . . 4. Dispersion parameters for oxides and fluorides: Transition metal. . . . . . . . . . . . . . . . . . . . . . . . . . . . 5. Dispersion parameters for oxides and fluorides d 10. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6. Dispersion parameters for oxides and fluorides p 6. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7. Dispersion parameters for oxides and fluorides s 2. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 8. Dispersion parameters for H2 O and crystalline hydrates. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 9. Dispersion parameters associated with ions. . . . . . List of Figures 1. Mean dispersion values 具 A 典 vs frequency of occurrence. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2. Dispersion A vs average Sellmeier energy gap Eo . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 3. Dispersion A vs average oscillator strength. . . . . . 967 968 968 968 969 970 934 957 959 960 961 962 964 965 966 959 959 960 1. Introduction Refractive indices (n) and their dispersion are useful for the characterization of synthetic materials and minerals and for the prediction of linear and nonlinear refractive indices (n 2 ). Nonlinear refractive indices are defined by: n⫽n o ⫹n 2 具 E 2 典 where n⫽observed refractive index at wavelength , n o⫽the linear refractive index, and E⫽the applied optical electric field 关Adair et al. 共1989兲兴. For example, nonlinear refractive indices of crystalline and glassy optical crystals have been related to linear refractive indices and their dispersion 关Boling et al. 共1978兲; Adair et al. 共1989兲; Dimitrov and Sakka 共1996兲兴. Also, in conjunction with dispersion studies and derived values of n ⬁ , sets of empirical electronic ion polarizabilities ␣ e have been derived from 共1兲 the Lorenz–Lorentz 共LL兲 equation: ␣ e⫽1/b 关共 V m兲共 n ⬁2 ⫺1 兲 / 共 n ⬁2 ⫹2 兲兴 , 共1兲 where V m is the molar volume in Å , b⫽4 /3 关Lorentz 共1880兲; Lorenz 共1880兲; Tessman et al. 共1953兲; Kip 共1962兲; Anderson 共1974兲兴 and n ⬁ is the value of n extrapolated to infinite wavelength from a Sellmeier equation and 共2兲 the additivity rule for the compound M2 M⬘ X4 . The additivity rule states 3 ␣ e共 M2 M⬘ X4 兲 ⫽2 ␣ e共 M2⫹ 兲 ⫹ ␣ e共 M⬘ 4⫹ 兲 ⫹4 ␣ e共 X⫽ 兲 , 共2兲 where ␣ e(M2 M⬘ X4 ) is the total polarizability of the compound M2 M⬘ X4 and ␣ e(M2⫹ ), ␣ e(M⬘ 4⫹ ), and ␣ e(X⫽ ) are the electronic polarizabilities of M2⫹ , M⬘ 4⫹ , and X⫽ , respectively. Using these relations, sets of ion polarizabilities were derived from data on the alkali halides and alkaline earth chalcogenides by Tessman et al. 共1953兲; Pirenne and Kartheuser 共1964兲; Wilson and Curtis, 共1970兲; Boswarva 共1970兲; Coker 共1976兲; Raghurama and Narayan 共1983兲; and from data on a variety of minerals by Lasaga and Cygan 共1982兲. During the course of the determination of an improved set of electronic polarizabilities, it was necessary to obtain a relatively complete database of refractive indices and dispersion over the visible part of the spectrum 共400–700 nm兲. Although dispersion data such as those given in the compilations of Hintze 共1897兲, 共1933兲, 共1938兲, 共1960兲; Doelter 共1914兲, 共1917兲; Li 共1980兲 and the Landolt-Börnstein 共1962兲, 共1969兲, 共1979兲, 共1981兲, 共1996兲, 共hereafter referred to as LB兲 series have been published, there was no central location for these data and it was frequently necessary to go to original publications to obtain dispersion data. Often there is no indication of the reliability of the data. In order to obtain n ⬁ and dispersion constants, it is convenient to use Sellmeier analyses. Sellmeier constants have been provided for many compounds in these publications, but because of the large variety of Sellmeier equations 关Tropf et al. 共1995兲兴, analysis using a common Sellmeier equation was not available. To remedy this situation a literature search from the mid 1800s to the present was done to provide a relatively complete list of refractive indices and dispersion for minerals and synthetic fluorides and oxides 共509 oxides and 55 fluorides兲. To be of use in the LL analysis, it is necessary that composition and unit cell volumes be available. Using the dispersion data and the one-term Sellmeier equation described by DiDomenico and Wemple 共1969兲, we calculate dispersion parameters, the long-wavelength index n ⬁ , and n D, the index of refraction at the NaD line. Using estimated experimental errors in n, comparisons of data on like compounds and trends in n and dispersion in structural families, we make a critical evaluation of the data. Finally, from the values of n ⬁ , the unit cell volumes, and the LL equation, we calculate the total mean polarizability 具 ␣ e典 for each compound. 2. Presentation of Data 2.1. Composition, Characterization, and Source This publication provides the composition, the refractive indices at ⫽⬁ (n ⬁ ), and 589.3 nm (n D), molar volume of the compounds V m , volume per anion V o , total mean electronic polarizabilities 具 ␣ e典 , the mean dispersion parameters 具 A 典 , 具 B 典 , 具 E o典 , and 具 E d典 , along with documentation providing an indication of the method of measuring n, the precision of the measurement of n, and source reference in an easily accessible form. Molar volume V m is the unit cell volume divided by Z, the number of molecules per unit cell. Volume J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION per anion V o is defined as the molar volume divided by the number of water molecules and anions (H2 O⫹O⫽ ⫹OH⫺ ⫹F⫺ ). In the text the values of 具 A 典 , 具 B 典 , 具 E o典 , and 具 E d典 for uniaxial and biaxial compounds, although written A, B, E o , and E d , are mean values. The compositions of synthetic compounds are generally accepted as correct. In the case of synthetic compounds, we give, when known, the crystal grower. Almost all of the data reported here are from single crystals. Exceptions are PLZT (Pb–La–Zr–Ti–O3 ) compositions. In this case the data from PbTiO3 ceramic with n ⫽2.523 ( ␣ e⫽9.668) was found to compare well to single crystal data where one paper 共Singh 1971兲 reported n o ⫽2.5218 and n e⫽2.5226 ( ␣ e ⫽9.665) and another 关Nomura et al. 共1973兲兴 n⫽2.5617 ( ␣ e⫽9.792). In those cases where single crystal data were not available, ceramic or polycrystalline sample is specified. In the case of minerals we give the mineral name, the color, and where available, the source of the specimen. Mineral compositions are generally those given by the original author. Following the composition, the symbol * refers to well known compositions, either as-grown synthetic crystals or analyzed compositions of minerals. Many values of n and dispersion for oxides and minerals have been reported in the literature but we have only included those for which the unit cell is known and the composition is relatively certain. In some instances such as phenacite (Be2 SiO4 ), even though no analysis was reported in the original papers, the data were included because of the high probability of the composition being correct. Many compositions, especially those reported in LB 共1962兲, 共1969兲, 共1979兲, 共1981兲, 共1996兲; Hintze 共1897兲, 共1933兲, 共1938兲, 共1960兲; and Doelter 共1914兲, 共1917兲 are uncertain or questionable. In the case of the minerals, narsarsukite, leucosphenite, and sodalite, even though the analysis or unit cell dimensions are not well known, we have included the data because the refractive index was well determined. For these entries, we have used in parentheses the nominal or ideal compositions. In some cases, data from LB was omitted if the composition was uncertain and there were other examples available where the composition was known, e.g., garnets, cordierites, and beryls. In some instances such as for KH2 PO4 , where a number of accurate determinations of n have been made, we have included only 1 or 2 of the more accurate measurements. Finally, we give the source of the data. In many cases, we give the compilation from which the data were taken, e.g., Palik 共1991兲; Hintze 共1897兲, 共1933兲, 共1938兲, 共1960兲; or Landolt-Börnstein 共1962兲, 共1969兲, 共1979兲, 共1981兲, 共1996兲. When convenient, we give the original reference using the CASSI 共Coden listed in the Chemical Abstracts Service Source Index兲 共1999兲. Appendix 1 lists the Codens used in this paper. The effective cutoff date for literature search is January 2000, whereas the earliest source was around 1850. Although Table 1 lists many of the dispersion data published between 1850 and 2000, it is not meant to be a complete tabulation. Overall, we present data for 509 oxides and 55 fluorides. 933 2.2. Method of Measuring Dispersion or n ⴥ Although prism techniques have been used in the majority of dispersion determinations, a variety of other techniques have also been used. We include a code describing the method used to measure the refractive indices. The prism method using either minimum deviation or perpendicular incidence 关Tilton 共1935兲; Tilton et al. 共1949兲; Werner 共1968兲; Tentori and Lerma 共1990兲; Medenbach and Shannon 共1997兲; Medenbach et al. 共2001兲兴 has been used most often 共about 60% of the data given here兲 and can give the refractive indices accurate to the fourth or fifth decimal place. The immersion method 关Werner 共1968兲; Verkouteren et al. 共1992兲兴 共about 10% of the data given here兲 is less accurate but can give values accurate to the 4th decimal place. Infrared reflectivity 共IR兲 measurements in conjunction with Kramers– Kronig analysis or the Lorentz oscillator model and classical dispersion theory 关Barker 共1964兲兴 give the long wavelength dielectric constant, ⬁ ⫽n ⬁2 , from fitting the parameter ⬁ to the reflectivity data. In general, data obtained in this manner 共about 10% of the data given here兲 are accurate to the third decimal place. Some papers use an independent measurement of n ⬁ and it is not always possible to distinguish these values from the fitted values. When both IR and minimum deviation measurements have been made, they have both been tabulated for comparison. Ellipsometer methods 关Jellison 共1997兲; Jellison and Modine 共1997兲兴 have been used more recently and give results somewhat less accurate than prism methods. We have compared several sets of data using both ellipsometer and prism methods and find agreement to ⫾0.02– 0.05. Critical angle methods including the use of the Abbe–Pulfrich refractometer 关Straat and Forrest 共1939兲; Tilton 共1942, 1943兲; Hurlbut 共1984兲兴 have been used often but not in determining dispersion. Finally, interference methods using a Michelson-type interferometer have also been used for determining dispersion 关Grehn 共1959兲; Werner 共1968兲; Moskalev and Smirnova 共1987兲; Shumate 共1966兲兴. The method of measuring n is not always given. Values quoted to four decimal places in LB were assumed to be obtained by prism methods and therefore to be accurate to ⫾0.0001– 0.0005, except when indicated otherwise. 2.3. Sellmeier Analysis There are many dispersion formulas that have been developed to fit the refractive index over a wide range of frequencies. Many of the most common formulas are described by Tropf et al. 共1995兲. However, the single-term Sellmeier equation used by DiDomenico and Wemple 共1969兲 and Wemple and DiDomenico 共1971兲 has the advantages of simplicity and of providing derived parameters that have physical significance. In the form 1/共 n 2 ⫺1 兲 ⫽⫺A/ 2 ⫹B, 共3a兲 A, the slope of the plot of (n 2 ⫺1) ⫺1 versus ⫺2 in units of 10⫺16 m2 gives a measure of dispersion and B, the intercept J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Simple Fluorides LiF*⫹ NaF*⫹ KF* RbF* CsF* alpha CsF* beta AgF film MgF*⫹ 2 MgF*2 CaF*⫹ 2 CaF*2 SrF*⫹ 2 SrF*2 BaF*⫹ 2 BaF*2 MnF*2 FeF*2 FeF*2 NiF*2 FL ZnF*2 ZnF*2 CdF*2 PbF*⫹ 2 PbF*⫹ 2 PbF*2 EuF*2 LaF*⫹ 3 LaF*⫹ 3 CeF*⫹ 3 PrF*⫹ 3 NdF*⫹ 3 TbF*⫹ 3 Complex Fluorides NaCoF*3 IR NaNiF*3 IR KMgF*⫹ 3 KMgF*3 KMnF*3 KMnF*⫹ 3 FL KMnF*3 FL KCoF*3 KCoF*3 KNiF*⫹ 3 Chemical composition, sample designations 1.3858 1.3196 1.355 1.389 1.469 1.566 1.73 1.3722 1.38 1.4255 1.430 1.4306 1.44 1.4655 1.47 1.462 1.498 1.508 1.493 1.486 1.45 1.49 1.7248 1.7272 1.58 1.555 1.5954 1.5934 1.6050 1.6077 1.6074 1.5768 1.470 1.442 1.3975 1.43 1.45 1.4382 1.439 1.500 1.50 1.4827 1.470 1.442 1.3975 1.43 1.45 1.4382 1.439 1.500 1.50 1.4827 ny 1.3858 1.3196 1.355 1.389 1.469 1.566 1.73 1.3722 1.38 1.4255 1.430 1.4306 1.44 1.4655 1.47 1.462 1.498 1.508 1.493 1.486 1.45 1.49 1.7248 1.7272 1.58 1.555 1.5954 1.5934 1.6050 1.6077 1.6074 1.5931 nx 1.470 1.442 1.3975 1.43 1.45 1.4382 1.439 1.500 1.50 1.4827 1.3858 1.3196 1.355 1.389 1.469 1.566 1.73 1.3838 1.38 1.4255 1.430 1.4306 1.44 1.4655 1.47 1.491 1.509 1.512 1.529 1.517 1.61 1.49 1.7248 1.7272 1.58 1.555 1.5910 1.5860 1.5985 1.6017 1.6016 1.5510 nz 1.526 1.495 1.7668 1.7680 1.6058 1.6039 1.6183 1.6207 1.6191 1.5868 1.526 1.495 1.7668 1.7680 1.6058 1.6039 1.6183 1.6207 1.6191 1.6034 1.4929 1.472 1.514 1.472 1.514 1.4929 1.4742 1.4742 1.4469 1.4377 1.4377 1.4469 1.4336 1.4336 1.4030 1.3774 1.3774 1.4030 1.3916 1.3255 1.360 1.398 1.479 1.578 nDy 1.3916 1.3255 1.360 1.398 1.479 1.578 nDx 1.4929 1.4469 1.4030 1.6004 1.5968 1.6113 1.6146 1.6132 1.5603 1.7668 1.7680 1.561 1.525 1.501 1.524 1.4742 1.4377 1.4336 1.3892 1.3916 1.3255 1.360 1.398 1.479 1.578 nDz 59.11 57.13 64.00 64.00 73.45 73.45 73.45 67.32 67.32 64.67 16.21 24.88 38.07 45.13 54.05 54.38 29.77 32.55 32.55 40.74 40.74 48.60 48.60 59.44 59.44 39.30 36.56 36.56 33.35 34.75 34.75 39.14 52.38 52.38 52.38 48.98 54.77 54.77 53.14 51.94 51.35 49.64 Vm 19.70 19.04 21.33 21.33 21.33 24.48 24.48 22.44 22.44 21.56 16.21 24.88 38.07 45.13 54.05 54.38 29.77 16.28 16.28 20.37 20.37 24.30 24.30 29.72 29.74 19.65 18.28 18.28 16.67 17.38 17.38 19.57 26.19 26.19 26.19 24.49 18.26 18.26 17.71 17.31 17.12 16.54 Vo 3.937 3.609 3.683 3.947 4.712 4.605 4.612 4.727 4.727 4.407 0.909 1.177 1.981 2.548 3.594 4.235 2.837 1.783 1.800 2.489 2.512 3.001 3.058 3.927 3.959 2.626 2.574 2.608 2.361 2.425 2.454 2.701 4.964 4.977 4.162 3.753 4.436 4.418 4.357 4.275 4.225 3.908 具 ␣ e典 0.0071 0.0075 0.0058 0.0046 0.0049 0.0058 0.0057 0.0051 0.0049 0.0114 0.0125 0.0198 0.0059 0.0063 0.0095 0.0066 0.0064 0.0074 0.0062 0.0064 0.0096 0.0074 0.0101 0.0074 0.0058 具A典 0.8344 0.9360 1.0494 0.6490 0.6532 0.6374 0.6336 0.6339 0.6782 0.5042 0.5063 0.7909 0.8076 0.8547 0.7961 0.8714 0.9555 0.9689 1.1193 1.0863 1.3489 1.1977 1.0770 0.8642 0.6884 具B典 13.69 14.17 16.96 15.03 14.59 13.23 13.36 14.08 14.94 8.41 8.05 8.00 14.83 14.76 11.57 14.52 15.51 14.47 16.97 16.47 14.97 16.04 13.03 13.69 13.78 具 Eo典 16.41 15.14 16.16 23.15 22.34 20.76 21.09 22.21 22.03 16.67 15.90 10.11 18.37 17.27 14.54 16.66 16.23 14.93 15.16 15.16 11.10 13.39 12.10 15.84 20.02 具 Ed典 73 73 75 67 67 75 72 72 67 84 51 78 76 76 76 62 72 78 64 63 62 80 62 64 62 73 73 80 73 73 64 65 86 78 65 66 66 83 83 83 83 81 Year PSSABA PSSABA OPSUA3 JAPIAU JAPIAU OPSUA3 OPSUA3 OPSUA3 JAPIAU SPHJAR JRNBAG Ref. 7 JPCRBU JPCRBU JPCRBU Ref. 1 JCPSA6 Ref. 7 PRVAAH APOPAI PHRVAO JPCRBU PHRVAO JOSAAH PHRVAO PSSBBD PSSBBD JOPQAG PSSBBD PSSBBD PRVAAH PRVAAH Ref. 4 Ref. 7 PRVAAH JPCSAW APOPAI PMABDJ PMABDJ PMABDJ PMABDJ PRBMDO Coden 16 16 39 38 38 39 33 33 38 59 139 27 5 48 48 48 48 23 136 2 127 9 127 54 127 57 57 41 57 57 136 139 5 5 5 Rf 56 47 Vol 419 419 390 4616 4616 390 97 97 4616 1316 25 7-105 329 329 329 189 3735 7-95 1290 1103 1950 161 1950 628 1950 681 681 543 681 681 1290 1211 28 7-94 1211 621 1966 203 203 203 203 6307 Page M 3 3 1 3 3 1 3 3 3 6 1 1 1 1 1 1 4 1 3 1 3 1 3 1 3 8 8 5 8 8 3 3 1 1 3 2 1 1 1 1 1 1 E 4 4 1 5 5 1 4 4 5 1 1 2? 3 3 3 4 5 1 5 1 4 1 5 1 5 5 5 4 5 5 5 7 1 1 7 4 1 2 2 2 2 2 TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲 934 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions RbMnF*⫹ 3 RbMnF*3 CsNiF*⫹ 3 BaLiF*3 LiYF*⫹ 4 LiTbF*⫹ 4 NaBF*⫹ 4 *⫹ KBF4 avogadroite 共synthetic兲 BaMgF*⫹ 4 FE BaMgF*4 FE BaZnF*⫹ 4 FE Na2 SbF*5 Na2 SiF6 malladrite Rb2 SiF*⫹ 6 Cs2 SiF*⫹ 6 * Cs2 SiF6 Na3 Li3 Al2 F12 cryolithionite Na2 GeF*⫹ 6 Rb2 GeF*⫹ 6 *⫹ Cs2 GeF6 Cs2 GeF*6 LiCaAl.99Cr.01F*⫹ 6 BaY2 F*⫹ 8 MgSiF6•6 H2 O*⫹ FL 298 K MnSiF6•6 H2O*⫹ FL 223 K FeSiF6•6 H2O*⫹ FL? NiSiF6•6 H2O*⫹ FL? CuSiF6•6 H2O*⫹ FL? ZnSiF6•6 H2O*⫹ FL? PbFCl* matlockite 共Cromford, Derbyshire兲 Chlorides LiCl*⫹ NaCl*⫹ halite KCl*⫹ sylvite RbCl*⫹ CuCl* AgCl*⫹ TlCl* SrCl*2 Simple Oxides H2 O*⫹ ice H2 O*⫹ ice H2 O* water KNiF*3 KZnF*3 Chemical composition, sample designations 1.52 1.53 1.4745 1.59 1.4681 1.50 1.4464 1.4648 1.3035 1.3197 1.4411 1.435 1.4871 1.463 1.3090 1.3484 1.3793 1.382 1.3337 1.3311 1.3904 1.3921 1.417 1.3869 1.5266 1.3372 1.3492 1.3556 1.3799 1.3998 1.3747 2.058 1.6580 1.5260 1.4732 1.4760 1.884 1.9911 2.112 1.691 1.3011 1.3007 1.319 1.6580 1.5260 1.4732 1.4760 1.884 1.9911 2.112 1.691 1.3011 1.3007 1.319 ny 1.52 1.53 1.4745 1.59 1.4681 1.50 1.4464 1.4648 1.2973 1.3193 1.4660 1.465 1.5107 1.441 1.3090 1.3484 1.3793 1.382 1.3337 1.3311 1.3904 1.3921 1.417 1.3869 1.5149 1.3372 1.3492 1.3556 1.3799 1.3998 1.3747 2.058 nx 1.3025 1.3021 1.319 1.6580 1.5260 1.4732 1.4760 1.884 1.9911 2.112 1.691 1.52 1.53 1.4745 1.59 1.4983 1.50 1.4684 1.4934 1.2971 1.3200 1.4585 1.455 1.5037 1.422 1.3053 1.3484 1.3793 1.382 1.3337 1.3252 1.3839 1.3921 1.417 1.3854 1.5063 1.3532 1.3663 1.3780 1.3962 1.4017 1.3876 1.944 nz 1.3091 1.3090 1.333 1.3091 1.3090 1.333 1.973 2.0615 2.249 1.973 2.0615 2.249 1.4536 1.4735 1.3071 1.3248 1.4490 1.447 1.4967 1.476 1.3124 1.3534 1.3847 1.391 1.3395 1.3376 1.3961 1.3985 1.430 1.3923 1.5356 1.3440 1.3568 1.3638 1.3902 1.4092 1.3823 2.145 1.4536 1.4735 1.3009 1.3243 1.4724 1.471 1.5214 1.467 1.3124 1.3534 1.3847 1.391 1.3395 1.3376 1.3961 1.3985 1.430 1.3923 1.5235 1.3440 1.3568 1.3638 1.3902 1.4092 1.3823 2.145 1.5443 1.4898 1.4784 1.4784 1.5443 1.4898 1.4837 nDy 1.4837 nDx 1.3105 1.3105 1.333 1.973 2.0615 2.249 1.5443 1.4898 1.4763 1.5029 1.3006 1.3113 1.4657 1.465 1.5144 1.435 1.3088 1.3534 1.3847 1.391 1.3395 1.3317 1.3898 1.3985 1.430 1.3909 1.5145 1.3601 1.3738 1.3845 1.4060 1.4090 1.3954 2.006 1.5102 1.4837 nDz 32.14 32.14 33.94 44.86 62.31 71.26 39.72 42.72 56.72 84.90 64.67 66.68 76.20 76.20 87.98 63.66 75.67 73.33 72.89 83.42 86.93 86.93 89.38 123.63 114.44 150.94 177.37 177.37 222.82 121.01 147.13 183.53 183.53 104.71 154.39 255.66 265.60 257.70 240.65 235.10 245.30 61.00 Vm 32.14 32.14 33.94 44.86 62.31 71.26 39.72 42.72 56.72 42.45 21.56 22.22 25.40 25.40 29.33 21.22 18.92 18.33 18.22 20.85 21.73 21.73 22.35 24.73 19.07 25.16 29.56 29.56 18.57 20.17 24.52 30.59 30.59 17.45 19.30 21.30 22.13 21.47 20.05 19.62 20.44 30.55 Vo 1.442 1.440 2.984 3.287 4.174 4.798 4.356 5.069 7.253 7.756 4.694 4.917 5.117 6.139 5.947 4.470 4.890 4.923 3.247 3.947 5.633 5.595 6.281 7.809 5.230 7.722 9.792 9.854 10.963 5.880 8.293 10.436 11.018 5.877 11.131 12.880 13.816 13.681 13.474 13.619 13.533 7.378 具 ␣ e典 0.0146 0.0152 0.0225 0.0161 0.0103 0.0148 0.0106 0.0120 0.0059 0.0066 0.0067 0.0082 0.0057 0.0075 0.0067 0.0142 0.0061 0.0068 0.0062 0.0098 0.0087 0.0101 0.0064 0.0068 0.0117 0.0061 0.0053 0.0097 0.0101 0.0097 0.0112 0.0089 0.0089 0.0106 0.0077 0.0066 具A典 1.4408 1.4428 1.3536 0.3919 0.3373 0.2888 0.7527 0.8546 0.8988 0.8529 1.4532 1.3706 0.8953 0.9034 0.7994 0.9276 1.4078 1.2221 1.1081 1.0985 1.2841 1.3047 1.0786 1.0660 0.9918 1.0845 0.7707 1.2470 1.1974 1.1667 1.0885 1.0402 1.1093 0.3260 0.8447 0.8516 具B典 12.57 12.31 9.80 6.25 7.24 5.59 10.64 10.68 15.55 14.40 18.64 16.36 15.79 13.85 13.80 10.23 19.26 16.96 16.90 13.39 15.40 14.40 16.47 15.80 11.67 16.91 15.28 14.34 13.78 13.89 12.45 13.66 14.14 7.01 13.26 14.32 具 Eo典 8.72 8.53 7.24 15.94 21.46 19.37 14.14 12.50 17.30 16.89 12.82 11.94 17.64 15.33 17.27 11.0 13.6 13.8 15.2 12.1 12.0 11.0 15.2 14.8 11.7 15.5 19.8 11.5 11.5 11.9 11.4 13.1 12.7 21.50 15.70 16.81 具 Ed典 62 62 91 76 62 62 76 28 62 62 74 67 67 84 67 82 89 75 78 86 38 77 75 75 78 62 82 82 35 62 82 82 82 35 95 95 74 62 62 74 62 62 62 Year Ref. 1 Ref. 1 Ref. 9 JPCRBU Ref. 1 Ref. 1 JPCRBU ZEKRDZ Ref. 1 Ref. 1 PSSBBD JAPIAU JAPIAU SPHJAR JAPIAU PRBMDO JCOMEL APOPAI JAPIAU ZEKRDZ Ref. 10C APHYCC JAPIAU JAPIAU JSSCBI Ref. 1 INOMAF INOMAF ZPCBAL Ref. 1 INOMAF INOMAF INOMAF ZPCBAL Ref. 13 Ref. 13 ACPHAA Ref. 1 Ref. 1 ACPHAA Ref. 1 Ref. 1 Ref. 1 Coden Rf Rf 5 Rf Rf 5 68 Rf Rf 62 1 Rf Rf 1 Rf Rf Rf 14 46 46 23 Rf 18 18 31 Rf 18 18 18 31 38 38 59 38 25 1 14 49 174 Vol 2835 2835 1059 329 3905 237 329 82 2749 12 511 4616 4616 1316 4616 6474 5613 2056 3464 313 48 403 4645 4645 187 143 570 570 292 18 570 570 570 292 599 600 5 189 589 5 2737 2737 300 Page 1 1 8 1 1 1 1 2 1 1 3 3 3 6 3 1 3 1 5 1 1 1 1 1 5 1 2 2 2 1 2 2 2 2 1 1 1 1 1 1 1 1 1 M 1 1 3 1 1 1 1 3 2 4 4 5 5 1 5 1 4 1 1 1 2 1 3? 2 5 2 2 2 3? 2 2? 2 2 3? 1 1 2 2 2 2 2 2 4 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲 —Continued REFRACTIVE INDEX AND DISPERSION 935 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Li2 O LiOH* Cu2 O cuprite film Cu2 O cuprite polyxtal Cu2 O cuprite polyxtal Cu2 O cuprite Cu2 O cuprite 关polyxtal reflectance data兴 BeO*⫹ MgO*⫹ Mg共OH兲⫹ 2 brucite 共Wood Mine, Lancaster, PA兲 CaO*⫹ SrO*⫹ BaO*⫹ MnO* MnO* MnO 关polyxtal reflectance data兴 CoO* NiO* NiO* ZnO*⫹ ZnO* ZnO* ZnO 关polyxtal reflectance data兴 CdO film PbO* red litharge FL 200 K EuO* EuO* B2 O*3 共estimated n ⬁ values兲 B2 O*3 共n D values兲 Al2 O*⫹ 3 Al2 O*⫹ 3 Al2 O*3 Al0.99Fe.01OOH*⫹ diaspore 共Turkey兲 Sc2 O*⫹ 3 共W. Yen兲 Cr2 O*3 Mn2 O3 关polyxtal reflectance data兴 Fe1.98Fe共2⫹ 兲.02O*3 hematite 共Elba兲 Fe2 O3 关average n, polyxtal reflectance data兴 FeOOH goethite FeOOH lepidocrocite Y2 O*⫹ 3 Y2 O*⫹ 3 Y2 O*⫹ 3 Y2 O*⫹ 3 Chemical composition, sample designations 1.637 1.4491 2.54 2.55 2.57 2.27 2.68 1.7050 1.7147 1.5501 1.8053 1.8277 1.9167 2.11 2.22 2.07 2.30 2.39 2.32 1.9102 1.901 1.898 1.90 2.37 2.535 1.960 2.30 1.635 1.648 1.7520 1.7504 1.79 1.6881 1.9536 2.490 2.81 2.602 2.50 2.123 1.861 1.8915 1.8962 1.8903 1.8815 nx 1.637 1.4491 2.54 2.55 2.57 2.27 2.68 1.7050 1.7147 1.5501 1.8053 1.8277 1.9167 2.11 2.22 2.07 2.30 2.39 2.32 1.9102 1.901 1.898 1.90 2.37 2.535 1.960 2.30 1.635 1.648 1.7520 1.7504 1.79 1.7070 1.9536 2.490 2.81 2.602 2.50 2.209 2.011 1.8915 1.8962 1.8903 1.8815 ny 1.637 1.4408 2.54 2.55 2.57 2.27 2.68 1.7201 1.7147 1.5728 1.8053 1.8277 1.9167 2.11 2.22 2.07 2.30 2.39 2.32 1.9245 1.911 1.914 1.90 2.37 2.665 1.960 2.30 1.602 1.615 1.7449 1.7430 1.76 1.7325 1.9536 2.470 2.81 2.446 2.50 2.220 2.194 1.8915 1.8962 1.8903 1.8815 nz 1.4639 2.67 2.88 1.7184 1.7355 1.5665 1.8396 1.8710 1.9841 2.15 2.0222 2.008 2.004 1.99 1.7673 1.7233 1.9943 2.62 3.190 3.10 2.403 2.200 1.9311 1.9294 1.9301 1.9489 2.67 2.88 1.7184 1.7355 1.5665 1.8396 1.8710 1.9841 2.15 2.0222 2.008 2.004 1.99 1.7673 1.7028 1.9943 2.62 3.190 3.10 2.274 1.938 1.9311 1.9294 1.9301 1.9489 nDy 1.4639 nDx 2.62 2.912 3.10 2.409 2.515 1.9311 1.9294 1.9301 1.9489 1.7503 1.9943 1.7598 2.0256 2.023 2.021 1.99 2.15 2.67 2.88 1.7342 1.7355 1.5853 1.8396 1.8710 1.9841 1.4518 nDz 24.51 27.44 38.91 38.91 38.91 38.91 38.91 13.79 18.67 40.90 27.83 33.16 42.48 22.00 22.00 22.00 19.30 18.21 18.21 23.55 23.55 23.55 23.55 25.88 38.35 34.00 34.00 45.26 45.26 42.45 42.45 42.45 29.51 59.64 48.10 52.15 50.32 50.32 34.65 37.34 74.50 74.50 74.50 74.50 Vm 24.51 27.44 38.91 38.91 38.91 38.91 38.91 13.79 18.67 20.45 27.83 33.16 42.48 22.00 22.00 22.00 19.30 18.21 18.21 23.55 23.55 23.55 23.55 25.88 38.35 34.00 34.00 15.09 15.09 14.15 14.15 14.15 14.75 19.88 16.03 17.38 16.77 16.77 17.33 18.67 24.83 24.83 24.83 24.83 Vo 2.100 1.748 5.992 6.012 6.051 5.393 6.254 1.286 1.750 3.146 2.854 3.469 4.779 2.810 2.978 2.745 2.711 2.656 2.581 2.646 2.624 2.622 2.616 3.745 5.979 3.948 4.777 3.815 3.878 4.127 4.120 4.252 2.750 6.894 7.265 8.676 7.774 7.645 4.606 4.522 8.220 8.250 8.212 8.154 具 ␣ e典 0.0226 0.0255 0.0162 0.0215 0.0075 0.0062 0.0075 0.0126 0.0051 0.0066 0.0042 0.0159 0.0185 0.0182 0.0152 0.0099 0.0267 0.0086 0.0043 0.0064 0.0079 0.0080 0.0095 0.0116 0.0110 具A典 0.1453 0.1824 0.1898 0.2658 0.3323 0.3879 0.3853 0.3886 0.3937 0.5209 0.3550 0.4851 0.3690 0.3808 0.3814 0.3813 0.3050 0.2401 0.1616 0.5197 0.5154 0.7014 0.4426 0.4272 0.3740 0.9160 具B典 5.16 3.59 3.45 5.12 4.97 9.11 9.93 9.09 7.07 12.77 9.24 13.53 6.09 5.74 5.79 6.33 7.02 3.79 5.48 13.94 11.35 11.94 9.38 8.48 7.17 11.53 具 Eo典 35.4 19.68 18.17 19.28 14.96 23.50 25.78 23.38 17.95 24.51 26.03 27.89 16.51 15.08 15.19 16.61 23.02 15.80 33.90 26.82 22.02 17.03 21.19 19.85 19.17 12.59 具 Ed典 84 33 63 73 66 62 79 66 52 62 66 66 75 69 69 79 65 65 59 65 54 98 79 60 77 68 69 38 38 58 94 63 97 01 65 79 62 79 62 19 68 91 91 91 Year SSCOA4 ZPCBAL JCPSA6 JPCSAW PHRVAO Ref. 1 JJAPA5 AMMIAY JRNBAG Ref. 1 JAPIAU PHRVAO JAPIAU SSCOA4 SSCOA4 JJAPA5 JAPIAU JAPIAU PHRVAO JAPIAU ZAPHAX PRBMDO JJAPA5 ZEPYAA JCDTBI PKOMA3 JPCSAW AJSCAP AJSCAP JOSAAH JAPIAU PRVAAH JOBPDE JOAOF8 PHVAAH JJAPA5 Ref. 1 JJAPA5 Ref. 1 AJSCAP JJAPA5 Ref. 9 Ref. 9 Ref. 9 Coden 51 20 39 34 141 Rf 18 51 49 Rf 37 143 46 7 7 18 36 36 114 36 6 58 18 158 1977 8 30 35 35 48 76 132 14 3 138 18 Rf 18 Rf 47 7 Vol 421 65 1789 2201 803 2749 1043 141 249 697 2450 595 443 977 109 1043 2446 2446 1507 1674 257 3586 1043 511 1096 80 1403 143 143 629 8032 1474 3299 174 A530 1043 685 1043 3562 311 404 1079 1079 1079 Page M 3 2 3 3 3 8 8 1 1 1 1 1 1 3 3 8 3 3 3 1 1 4 8 8 3 1 3 2 2 1 4 3 1 1 3 8 8 8 8 2 8 1 1 1 E 5 1 5 5 5 5 5? 1 1 2 1 1 1 5 5 5 5 5 5 1 3 3 5 5 4 4 7 5 5 1 2 5 1 1 4 5? 3 5 3 5 2 2? 2 2? TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 936 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions In2 O3 film As2 O*⫹ 3 arsenolite 共probably synthetic兲 As2 O*3 arsenolite Sb2 O*⫹ 3 senarmontite 共Algeria兲 Sb2 O*3 senarmonite Bi2 O*3 alpha Bi2 O*3 关IR data, not accurate, not cubic兴 * Bi12SiO20 *⫹ Bi12GeO20 *⫹ Bi12TiO20 Bi12TiO20 :Ga*⫹ * Bi12TiO20 Bi12Ga.72Bi.28O19.5 Pr2 O*3 cubic Nd2 O*3 cubic FL 293 K Nd2 O3 hexagonal 共n ⬁ from extrapolation of ␣ vs at. no.兲 Sm2 O3 monoclinic 共n ⬁ from extrapolation of ␣ vs. at. no.兲 Eu2 O*3 Eu2 O*3 cubic 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Gd1.98Nd.02O*3 关Sci. Mat. Corp 共assume n y⫽n z兲兴 Gd2 O*3 cubic Gd2 O*3 cubic 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Tb2 O*3 Tb2 O*3 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Dy2 O*⫹ 3 共W. Yen兲 Dy2 O*3 Ho2 O*3 Ho2 O*3 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Er2 O*3 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Er2 O*3 Er2 O*3 Er2 O*3 Tm2 O*3 Tm2 O*3 共n ⬁ from interpolation of n ⬁ vs at. no.兲 Yb2 O*⫹ 3 Yb2 O*⫹ 3 共W. Yen兲 Y2 O*3 Chemical composition, sample designations 1.90 1.935 1.90 1.935 1.9332 1.895 1.892 1.928 1.923 1.930 1.888 1.95 1.882 1.918 1.9088 1.9096 2.055 2.021 1.9332 1.895 1.892 1.928 1.923 1.930 1.888 1.95 1.882 1.918 1.9088 1.9096 1.901 1.940 1.901 1.940 1.90 1.935 2.052 2.052 1.90 1.935 1.884 2.00 1.7185 1.725 2.0000 2.03 2.437 2.0 2.370 2.386 2.4065 2.4005 2.419 2.403 1.88 1.86 2.067 ny 1.884 2.00 1.7185 1.725 2.0000 2.03 2.344 2.0 2.370 2.386 2.4065 2.4005 2.419 2.403 1.88 1.86 2.067 nx 1.9332 1.895 1.892 1.928 1.923 1.930 1.888 1.95 1.882 1.918 1.9088 1.9096 1.90 1.935 1.90 1.935 2.055 1.901 1.940 2.052 1.884 2.00 1.7185 1.725 2.0000 2.03 2.530 2.0 2.370 2.386 2.4065 2.4005 2.419 2.403 1.88 1.86 2.067 nz 1.9757 1.963 1.960 1.959 1.956 1.950 1.9468 1.9470 1.959 1.956 1.950 1.9468 1.9470 1.96 1.96 2.102 1.9757 1.963 1.960 1.96 1.96 2.065 1.969 2.558 2.561 2.5873 2.5945 2.588 2.611 1.94 1.92 2.558 2.561 2.5873 2.5945 2.588 2.611 1.94 1.92 1.969 1.7537 1.755 2.0817 2.09 2.660 1.912 nDy 1.7537 1.755 2.0817 2.09 2.572 1.912 nDx 1.9468 1.9470 1.950 1.959 1.956 1.9757 1.963 1.960 1.96 1.96 2.102 1.969 2.558 2.561 2.5873 2.5945 2.588 2.611 1.94 1.92 1.7537 1.755 2.0817 2.09 2.785 1.912 nDz 75.86 75.86 74.57 74.57 73.33 73.33 73.33 73.33 72.07 72.07 70.98 70.98 77.19 77.19 79.01 79.01 72.41 80.05 80.05 74.87 74.50 64.72 84.96 84.96 86.68 86.68 82.60 82.60 514.80 521.30 526.54 526.54 526.54 526.60 86.87 85.01 76.78 Vm 25.29 25.29 24.86 24.86 24.44 24.44 24.44 24.44 24.02 24.02 23.66 23.66 25.73 25.73 26.34 26.34 24.13 26.68 26.68 24.96 24.83 21.57 28.32 28.32 28.89 28.89 27.53 27.53 25.74 26.07 26.33 26.33 26.33 26.33 28.96 28.34 25.59 Vo 8.640 8.393 8.231 8.461 8.289 8.333 8.068 8.455 7.892 8.116 7.937 7.942 8.573 8.804 8.775 9.011 8.890 8.898 9.163 9.240 8.171 7.725 7.998 8.053 10.347 10.551 12.268 9.860 74.494 75.920 77.301 77.121 77.673 77.205 9.497 9.143 9.563 具 ␣ e典 0.0069 0.0068 0.0126 0.0050 0.0125 0.0073 0.0123 0.0124 0.0122 0.0122 0.0062 0.0121 0.0126 0.0115 0.0115 0.0123 0.0106 0.0130 0.0119 0.0126 0.0105 0.0087 0.0116 0.0080 0.0138 0.0053 具A典 0.3782 0.3778 0.3933 0.3668 0.3898 0.3653 0.3858 0.3875 0.3853 0.3847 0.3151 0.3825 0.2167 0.2130 0.2087 0.2100 0.2060 0.2094 0.3947 0.4085 0.5119 0.5059 0.3334 0.3209 0.2034 0.3921 具B典 9.38 9.44 7.05 10.82 7.07 8.97 7.09 7.08 7.09 7.10 9.01 7.11 5.25 5.44 5.39 5.22 5.58 5.07 7.28 7.21 8.85 9.63 6.78 8.03 4.85 10.84 具 Eo典 24.81 24.98 17.93 29.51 18.14 24.54 18.38 18.27 18.41 18.44 28.61 18.58 24.2 25.5 25.8 24.8 27.0 24.2 18.44 17.65 17.28 19.03 20.33 25.02 23.86 27.65 具 Ed典 01 73 73 01 01 56 73 87 73 01 97 01 73 01 73 01 01 73 01 01 56 86 97 62 97 62 76 70 71 83 97 96 93 96 73 73 01 Year JOAOF8 JSTCAM JSTCAM JOAOF8 JOAOF8 ANCHAM JSTCAM SPSSA7 JSTCAM JOAOF8 JOBPDE JOAOF8 JSTCAM JOAOF8 JSTCAM JOAOF8 JOAOF8 JSTCAM JOAOF8 JOAOF8 ANCHAM JAPIAU JOBPDE Ref. 1 JOBPDE Ref. 1 MRBUAC PSSABA JAPIAU JOSAAH JNOMFV JOBPDE PSSABA JOBPDE JSTCAM JSTCAM JOAOF8 Coden 3 13 13 3 3 28 13 29 13 3 14 3 13 3 13 3 3 13 3 3 28 60 14 Rf 14 Rf 11 2 42 73 6 13 140 13 13 13 3 Vol 174 871 871 174 174 2023 871 1904 871 174 3299 174 871 174 871 174 174 871 174 174 2023 R123 3299 2565 3299 204 1551 K149 493 495 235 908 273 908 871 871 174 Page 1 2 2 8 8 2 2 4 2 8 1 1 2 8 2 8 1 2 8 8 2 3 1 8 1 8 1 8 1 8 1 1 1 1 2 2 8 M 1 4? 4? 4 3 3 3? 5 3? 3 1 1 5? 3 5? 3 3 5? 3 3 3? 5 1 3? 1 5? 3 5 4 6 2 2 3 4 5? 5? 3 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 937 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Yb2 O*3 Lu2 O*⫹ 3 共W. Yen兲 Lu2 O*3 SiO*⫹ 2 SiO*⫹ 2 smoky quartz SiO*⫹ 2 amethyst 共Zambia兲 SiO*⫹ 2 amethyst 共Para, Brazil兲 SiO*⫹ 2 共G. Rossman, X-O兲 SiO*⫹ 2 共G. Rossman, X-13兲 SiO*⫹ 2 共A. Ballman兲 SiO*⫹ 2 共G. Rossman, X-488-3兲 SiO*⫹ 2 smoky quartz SiO*2 GeO*⫹ 2 GeO*2 tetragonal GeO*2 tetragonal TiO*⫹ 2 rutile 共synthetic?兲 TiO*⫹ 2 rutile 共synthetic?兲 TiO*2 rutile mineral TiO*2 TiO*2 关average n, polyxtal reflectance data兴 TiO*2 brookite, brown TiO*⫹ 2 anatase, yellow 共Binnental兲 TiO*2 anatase 共Binnental兲 TiO*2 anatase 共Binnental兲 TeO*⫹ 2 FL 9 KBAR TeO*⫹ 2 FL 9 KBAR TeO*2 FL 9 KBAR SnO⫹ 2 cassiterite 共Araca, Bolivia兲 SnO*⫹ 2 cassiterite 共synthetic兲 SnO*⫹ 2 cassiterite 共synthetic兲 SnO*2 ZrO*2 cubic *⫹ Zr.869Y.131O1.934 *⫹ Zr.671Y.329O1.835 *⫹ Zr.894Y.095Hf.011O1.95 *⫹ Hf.904Y.096O1.952 *⫹ Hf.85Y.15O1.925 * CeO2 CeO*2 ThO*⫹ 2 共synthetic兲 ThO*2 共synthetic, Norton Refractories兲 ThO*2 ThO*2 Chemical composition, sample designations 1.879 1.8997 1.867 1.5324 1.5306 1.5330 1.5330 1.5327 1.5326 1.5328 1.5327 1.5331 1.535 1.9250 1.927 2.02 2.4252 2.4096 2.422 2.38 2.41 2.411 2.3852 2.3781 2.3740 2.1614 2.1690 2.27 1.9462 1.9442 1.9319 1.945 2.256 2.1082 2.0180 2.1193 2.0690 2.0486 2.36 2.31 2.0679 2.070 2.07 2.20 nx 1.879 1.8997 1.867 1.5324 1.5306 1.5330 1.5330 1.5327 1.5326 1.5328 1.5327 1.5331 1.535 1.9250 1.927 2.02 2.4252 2.4096 2.422 2.38 2.41 2.422 2.3852 2.3781 2.3740 2.1614 2.1690 2.27 1.9462 1.9442 1.9319 1.945 2.256 2.1082 2.0180 2.1193 2.0690 2.0486 2.36 2.31 2.0679 2.070 2.07 2.20 ny 1.879 1.8997 1.867 1.5411 1.5393 1.5418 1.5415 1.5412 1.5413 1.5416 1.5416 1.5417 1.544 2.0138 2.018 2.10 2.6666 2.6515 2.666 2.63 2.41 2.504 2.3386 2.3330 2.3294 2.3024 2.3070 2.43 2.0471 2.0449 2.0298 2.043 2.256 2.1082 2.0180 2.1193 2.0690 2.0486 2.36 2.31 2.0679 2.070 2.07 2.20 nz 1.942 1.9349 1.930 1.5435 1.5439 1.5444 1.5444 1.5441 1.5441 1.5442 1.5441 1.5443 1.9577 1.960 2.6190 2.6098 2.613 2.65 2.54 2.584 2.5621 2.5621 2.5608 2.2730 2.2753 2.0004 1.9982 1.9871 2.1581 2.0691 2.1698 2.1109 2.0881 2.1113 2.105 1.9577 1.960 2.6190 2.6098 2.613 2.65 2.54 2.585 2.5621 2.5621 2.5608 2.2730 2.2753 2.0004 1.9982 1.9871 2.1581 2.0691 2.1698 2.1109 2.0881 2.1113 2.105 nDy 1.942 1.9349 1.930 1.5435 1.5439 1.5444 1.5444 1.5441 1.5441 1.5442 1.5441 1.5443 nDx 2.1113 2.105 2.1581 2.0691 2.1698 2.1109 2.0881 2.0971 2.0942 2.0817 2.9031 2.8976 2.900 2.93 2.54 2.702 2.4889 2.4891 2.4879 2.4288 2.4310 2.0454 2.048 1.942 1.9349 1.930 1.5526 1.5530 1.5535 1.5533 1.5531 1.5531 1.5533 1.5533 1.5534 nDz 70.98 70.10 70.10 37.66 37.66 37.66 37.66 37.66 37.66 37.66 37.66 37.66 37.66 27.62 27.62 27.62 31.21 31.21 31.21 31.21 31.21 32.30 34.07 34.07 34.07 43.85 43.85 43.85 35.77 35.77 35.77 35.77 34.97 33.86 34.46 33.98 33.64 33.90 39.61 39.61 43.90 43.90 43.90 43.90 Vm 23.66 23.37 23.37 18.83 18.83 18.83 18.83 18.83 18.83 18.83 18.83 18.83 18.83 13.81 13.81 13.81 15.61 15.61 15.61 15.61 15.61 16.10 17.03 17.03 17.03 21.93 21.93 21.93 17.87 17.87 17.87 17.87 17.48 17.51 18.78 17.42 17.23 17.61 19.81 19.81 21.95 21.95 21.95 21.95 Vo 7.754 7.784 7.583 2.800 2.793 2.803 2.803 2.801 2.801 2.802 2.802 2.803 2.812 3.195 3.201 3.397 4.751 4.725 4.747 4.680 4.588 4.813 4.929 4.916 4.908 5.902 5.921 6.223 4.212 4.206 4.167 4.206 4.816 4.321 4.162 4.363 4.195 4.175 5.708 5.589 5.471 5.478 5.478 5.884 具 ␣ e典 0.0056 0.0044 0.0059 0.0072 0.0058 0.0053 0.0053 0.0081 0.0081 0.0086 0.0113 0.0119 0.0111 0.0152 0.0084 0.0107 0.0114 0.0119 0.0121 0.0108 0.0103 0.0054 0.0052 0.0119 0.0066 0.0123 0.0063 0.0076 0.0065 0.0065 0.0065 0.0065 0.0065 0.0065 0.0064 具A典 0.3052 0.3043 0.2903 0.3255 0.2863 0.3047 0.3128 0.3436 0.3446 0.3508 0.1911 0.1940 0.1915 0.1987 0.2070 0.2010 0.2168 0.2182 0.2191 0.2591 0.2571 0.3555 0.3540 0.3953 0.3833 0.4024 0.7369 0.7399 0.7359 0.7360 0.7364 0.7365 0.7362 0.7363 0.7358 具B典 9.37 10.49 8.89 8.50 8.91 9.56 9.74 8.22 8.24 8.08 5.21 5.11 5.24 4.57 6.27 5.49 5.52 5.42 5.37 6.20 6.32 10.30 10.40 7.27 9.67 7.24 13.62 12.47 13.45 13.46 13.45 13.41 13.45 13.44 13.52 具 Eo典 30.70 34.46 30.64 26.13 31.14 31.38 31.14 23.93 23.92 23.04 27.25 26.35 27.37 23.00 30.29 27.29 25.46 24.82 24.53 23.94 24.60 28.97 29.37 18.41 25.23 17.99 18.49 16.86 18.28 18.28 18.26 18.21 18.27 18.26 18.37 具 Ed典 73 01 73 78 97 97 97 97 97 97 97 97 61 00 82 72 65 97 28 97 79 28 28 16 08 90 71 73 62 62 76 68 86 82 90 97 90 77 87 82 97 64 66 66 Year JSTCAM JOAOF8 JSTCAM Ref. 7 NJMIAK JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE PHRVAO Ref. 14 MRBUAC JPCSAW JAPIAU JAPIAU ZEKRDZ OPLEDP JJAPA5 ZEKRDZ ZEKRDZ NJGAAY ZEKRDZ ZPSBAX PLRBAQ PLRBAQ Ref. 1 Ref. 1 JCRGAE JAPIAU JACTAW APOPAI APOPAI JOBPDE APOPAI INOMAF SPSSA7 PSSBBD JOBPDE OPACAT PHRVAO PHRVAO Coden 17 33 36 82 67 22 18 67 67 41 44 51 4 8 Rf Rf 32 39 69 21 29 14 29 13 29 114 14 11 151 151 11 14 14 14 14 14 14 14 121 13 3 13 Vol 1313 293 1674 994 485 1808 1043 485 485 342 313 790 3736 768 350 2810 259 3762 277 2978 2485 3299 604 1747 1904 189 3299 287 676 676 871 174 871 7-82 259 3299 3299 3299 3299 3299 3299 3299 1324 Page 2 1 2 1 1 1 1 1 1 1 1 1 3 1 1 3 1 8 1 4 8 1 1 1 1 1 1 8 1 1 1 3 8 1 1 1 1 1 4 3 1 1 1 3 M 3? 1 3? 1 1? 1 1 1 1 1 1 1 3 1 3 7 1 1 3 5? 5? 3 1 1 1 1 2 3 1 1 1 4 3 1 1 1 1 2 5 5 1 3 3? 7 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 938 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions NaBeSi3 O7 OH⫹ eudidymite NaBe4 SbO⫹ 7 swedenborgite Ba.98Ca.02Be2 Si2 O*⫹ 7 barylite 共Langban, Sweden兲 Borates BO共OH兲* ⫽ HBO2 I 共estimated n ⬁ values兲 BO共OH兲* ⫽ HBO2 I 共n D values兲 B3O4共OH兲•H2O*⫽HBO2 II 共estimated n ⬁ values兲 B3O4共OH兲•H2O*⫽HBO2 (n D values兲 B共OH兲*3 ⫽ H3 BO3 sassolite 共estimated n ⬁ values兲 B共OH兲*3 ⫽ H3 BO3 sassolite 共n D values兲 B共OH兲3 * ⫽ H3 BO3 sassolite 共estimated n ⬁ values兲 B共OH兲*3 ⫽ H3 BO3 sassolite 共nD values兲 LiB3 O*⫹ 5 Li2 B4 O*⫹ 7 FE 863 K CsB3 O⫹ 5 BeSO4•4 H2O*⫹ crystalline FL 31 K UO2 film FL 31 K UO*2 FL 31 K UO*2 FL 31 K V2 O*5 V2 O*5 Beryllates BeAl2 O*⫹ 4 chrysoberyl BeAl2 O*⫹ 4 chrysoberyl La2 Be2 O*⫹ 5 BeAlSiO4 OH⫹ euclase Be1.00Al.99Si1.00O4 OH*⫹ euclase 共San Sebastao de Maranhao, Minas Gerais兲 Be1.00Al.99Si4 OH*⫹ euclase 共Diamantina, Minas Gerais兲 ⫹ beryl 共no indication of H2 O Be3 Al2 Si6 O18 content or method of preparation兲 ⫹ beryl, colorless Be3 Al2 Si6 O18 共Santa Rita, Minas Gerais兲 ⫹ beryl, light-blue Be3 Al2 Si6 O18 共Klein Spitzkopje, SW Africa兲 ⫹ beryl, emerald, Be3 Al2 Si6 O18 light-green 共Columbia兲 UO*2 Chemical composition, sample designations 1.6422 1.5650 1.5562 1.5591 1.5617 1.6388 1.5650 1.5562 1.5591 1.5617 1.61 1.619 1.56 1.570 1.44 1.457 1.45 1.461 1.5889 1.5943 1.5376 1.61 1.619 1.42 1.434 1.33 1.340 1.32 1.337 1.5625 1.5943 1.5190 1.4585 1.5383 1.7550 1.6659 1.7270 1.7309 1.9820 1.6412 1.6425 1.7254 1.7291 1.9490 1.6380 1.6382 1.4585 1.5380 1.7550 1.6619 2.12 2.16 2.30 2.35 1.97 1.98 ny 2.12 2.16 2.30 2.35 2.07 2.20 nx 1.462 1.6026 1.5502 1.5654 1.459 1.45 1.588 1.45 1.619 1.57 1.61 1.4233 1.5424 1.7527 1.6820 1.5565 1.5545 1.5520 1.5589 1.6588 1.7325 1.7354 2.0180 1.6580 1.6589 2.12 2.16 2.30 2.35 2.12 2.29 nz 1.5752 1.6075 1.5308 1.4713 1.5457 1.7732 1.6921 1.5738 1.5715 1.5684 1.5774 1.6523 1.6023 1.6075 1.5615 1.4713 1.5461 1.7732 1.6977 1.5738 1.5715 1.5684 1.5774 1.6557 1.7417 1.7469 2.0243 1.6548 1.6558 2.10 2.89 1.7397 1.7442 1.9897 1.6509 1.6524 2.39 2.40 nDy 2.39 2.40 nDx 1.6172 1.5620 1.5892 1.4328 1.5512 1.7704 1.7029 1.5684 1.5667 1.5640 1.5708 1.6727 1.7473 1.7528 2.0629 1.6713 1.6730 2.55 2.39 2.40 nDz 68.52 80.09 115.47 121.37 68.52 68.52 35.48 68.52 29.22 35.48 29.22 170.86 158.02 113.46 134.37 338.40 338.40 338.40 338.40 78.05 56.99 56.99 102.90 78.05 78.05 40.87 40.87 40.87 40.87 89.52 89.52 Vm 22.84 16.02 16.49 24.27 22.84 22.84 17.73 22.84 14.61 17.73 14.61 21.36 19.75 16.21 19.20 18.80 18.80 18.80 18.80 15.61 14.25 14.25 20.58 15.61 15.61 20.43 20.43 20.43 20.43 17.90 17.90 Vo 4.140 6.405 9.169 9.100 4.128 4.024 2.619 4.024 2.447 2.561 2.419 10.894 11.828 11.082 11.982 26.121 26.029 25.922 26.236 6.768 5.421 5.441 12.143 6.761 6.768 5.250 5.366 5.742 5.866 11.057 11.732 具 ␣ e典 0.0064 0.0061 0.0107 0.0095 0.0046 0.0050 0.0096 0.0062 0.0064 0.0064 0.0062 0.0052 0.0043 0.0047 0.0065 0.0051 0.0053 0.0264 0.0264 0.0210 具A典 0.6624 0.6699 0.7291 0.9164 0.7298 0.4814 0.5592 0.6976 0.7012 0.7056 0.6931 0.5845 0.5033 0.5002 0.3415 0.5854 0.5846 0.2796 0.2876 0.2715 具B典 12.89 13.27 10.45 12.41 15.99 12.47 9.63 13.39 13.25 13.27 13.33 13.42 13.61 12.98 9.14 13.58 13.28 4.12 4.17 4.54 具 Eo典 19.46 19.8 14.3 13.5 21.9 25.9 17.2 19.2 18.8 18.8 19.2 22.96 27.05 25.94 26.7 23.20 22.71 14.73 14.51 16.74 具 Ed典 38 89 85 93 57 38 38 57 38 38 38 78 62 24 62 34 62 62 87 97 80 62 76 62 97 64 59 66 66 66 55 Year AJSCAP JOBPDE JAPNDE APPLAB AMMIAY AJSCAP AJSCAP AMMIAY AJSCAP AJSCAP AJSCAP APPLAB Ref. 1 ZEKRDZ Ref. 1 NJGAAY Ref. 1 Ref. 1 Ref. 5 JOBPDE IEJQA7 Ref. 1 JAPIAU Ref. 1 JOBPDE JOSAAH JOSAAH PHRVAO PHRVAO JPCSAW JACTAW Coden 35 6 24 62 42 35 35 42 35 35 35 33 Rf 60 Rf 68 Rf Rf 14 QE-16 Rf 47 Rf 14 54 49 151 151 27 38 Vol 143 616 25 2614 56 143 143 56 143 143 143 413 2537 262 743 401 424 424 305 3299 1302 1838 1496 4106 3299 265 1107 676 676 1237 306 Page 02 1 1 1 2 02 2 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8 8 8 3 8 2 M 3 1 1 1? 3 5 4 5 3 4 4 1 1 1 1 1 1 1 2 1 1 1 1 1 1 5 5 5 7 5 5 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 939 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions *⫹ hambergite Be2 BO3 共OH兲.96F.04 共Antsirabe, Tanarive, Madagascar兲 Be2 BO3 OH*⫹ hambergite Be2 BO3 OH*⫹ hambergite 共Madagascar兲 SrB4 O*⫹ 7 PbB4 O*⫹ 7 PbB4 O*7 BaB2 O4 -alpha*⫹ BaB2 O4 -alpha*⫹ BiB3 O*⫹ 6 piezoelectric LiGeBO*⫹ 4 Mg.98Fe.02AlBO*⫹ 4 sinhalite 共Ratnapura兲 KNbB2 O*6 RbNbB2 O*6 RbNbB2 O*6 Ca4 YOB3 O*9 Ca4 GdOB3 O*⫹ 9 KBe2 BO3 F*2 Mg3 BO3 F3 fluoborite, light brown Mg3 B7 O13Cl⫹ boracite FE 538K Mg3 B7 O13Cl⫹ boracite FE 538K LaGeBO*⫹ 5 FE 805 K *⫹ Y.99Nd.01Al3 B4 O12 *⫹ Gd.99Nd.01Al3 B4 O12 Na2B4O5共OH兲4•8 H2O*⫹ borax Na2B4O5共OH兲4•3 H2O*⫹ tincalconite 共synthetic兲 KB5O6共OH兲4•2 H2O*⫹⫽KB5O8•4 H2O K2B4O5共OH兲4•2 H2O*⫹ CaB3O4共OH兲3•H2O⫹ colemanite FE 266 K Cs.44K.31Rb.16Na.03Al4 Be4 B11O25共OH兲⫹ 4 rhodizite 共Manjaka, Madagascar兲 Aluminates LiAlO*⫹ 2 gamma-tetragonal Y.99Nd.01AlO*⫹ 3 FL? Y.99Nd.01AlO*⫹ 3 FL? YAlO*⫹ 3 FL? LaAlO*3 Mg1.02Al1.98Fe.01O*⫹ 4 spinel, purple 共Sri Lanka兲 CsB3 O*⫹ 5 *⫹ CsLiB6 O10 Zn4 O共BO2 兲*⫹ 6 Chemical composition, sample designations 1.5480 1.4825 1.7257 1.5759 1.5760 1.5764 1.7222 1.9013 1.901 1.656 1.6504 1.7724 1.6682 1.6826 1.731 1.737 1.737 1.6926 1.6995 1.471 1.5004 1.6553 1.6608 1.7948 1.7472 1.7732 1.4573 1.4518 1.4238 1.4556 1.5792 1.6777 1.6048 1.9173 1.9166 1.9162 2.00 1.6979 1.5434 1.5433 1.7210 1.8979 1.897 1.656 1.6504 1.7473 1.6682 1.6529 1.759 1.720 1.754 1.6613 1.6747 1.471 1.5004 1.6553 1.6608 1.7948 1.7472 1.7732 1.4356 1.4518 1.4745 1.4528 1.5734 1.6777 1.6048 1.9030 1.9035 1.9025 2.00 1.6979 ny 1.5298 1.4825 1.7257 1.5435 nx 1.5884 1.9249 1.9252 1.9246 2.00 1.6979 1.6777 1.4121 1.4690 1.6002 1.6148 1.6147 1.7247 1.9032 1.902 1.544 1.5390 1.9025 1.6725 1.6904 1.731 1.756 1.719 1.7098 1.7079 1.393 1.4798 1.6553 1.6608 1.8314 1.6803 1.7005 1.4605 1.4638 1.5746 1.4323 1.7257 1.6143 nz 1.6223 1.9432 1.9432 1.9423 1.7153 1.7153 1.6932 1.4336 1.4658 1.5919 1.5885 1.5885 1.7353 1.9351 1.934 1.676 1.6699 1.8111 1.6857 1.6967 1.777 1.778 1.777 1.7137 1.7216 1.479 1.5086 1.6713 1.6753 1.8201 1.7743 1.7886 1.4693 1.4625 1.5605 1.4943 1.7464 1.5886 nDy 1.6223 1.9525 1.9523 1.9277 1.6932 1.4863 1.4632 1.5861 1.5545 1.5542 1.7340 1.9304 1.930 1.676 1.6699 1.7806 1.6857 1.6664 1.806 1.758 1.802 1.6815 1.6957 1.479 1.5086 1.6713 1.6753 1.8201 1.7743 1.7886 1.4467 1.4625 1.5416 1.4943 1.7464 1.5546 nDx 1.7153 1.6038 1.9285 1.9285 1.9515 1.6932 1.4211 1.4799 1.6139 1.6288 1.6284 1.7377 1.9368 1.936 1.558 1.5523 1.9518 1.6914 1.7047 1.777 1.804 1.757 1.7268 1.7300 1.401 1.4858 1.6713 1.6753 1.8593 1.7023 1.7122 1.4723 1.4746 1.5879 1.4421 1.7464 1.6285 nDz 42.02 50.09 50.09 50.09 54.44 66.14 391.74 279.40 260.42 140.56 66.06 66.06 100.35 102.45 102.45 96.15 96.46 111.34 69.90 60.73 132.10 137.94 137.94 223.79 226.24 106.04 104.07 220.62 220.62 97.87 180.62 181.69 370.96 250.18 121.37 246.10 209.08 66.06 Vm 21.01 16.95 16.95 16.95 18.15 16.53 13.50 23.28 23.67 17.57 16.51 16.51 14.33 14.64 14.64 24.01 24.11 18.56 17.47 15.18 22.03 22.99 22.99 22.39 22.62 21.21 17.34 15.76 15.76 19.57 15.05 15.14 21.82 20.84 24.27 24.61 16.08 16.51 Vo 3.429 5.628 5.628 5.626 6.498 6.089 35.249 17.468 17.000 11.235 5.234 5.235 9.489 11.386 11.379 8.049 8.018 11.440 6.231 5.449 12.723 13.249 13.235 20.372 20.738 6.738 7.227 19.334 19.462 10.052 17.119 17.653 23.851 16.229 9.242 16.265 19.834 5.233 具 ␣ e典 0.0056 0.0075 0.0048 0.0048 0.0047 0.0054 0.0088 0.0081 0.0061 0.0060 0.0059 0.0040 0.0062 0.0062 0.0072 0.0073 0.0093 0.0063 0.0049 0.0127 0.0117 0.0117 0.0065 0.0071 0.0068 0.0050 0.0059 0.0053 0.0062 0.0075 0.0040 0.0093 0.0085 0.0067 0.0084 0.0061 0.0061 具A典 0.5311 0.6421 0.3749 0.3749 0.3753 0.5510 0.9437 0.8859 0.6626 0.6732 0.6731 0.5083 0.3827 0.3829 0.6231 0.6303 0.4453 0.5594 0.5539 0.4930 0.4952 0.4962 0.5415 0.5351 0.9268 0.8130 0.5747 0.5687 0.4417 0.5076 0.4871 0.9050 0.8936 0.7128 0.8735 0.5055 0.6734 具B典 12.27 11.73 11.21 11.23 11.26 12.83 13.12 13.19 13.13 13.36 13.48 14.35 9.94 9.95 11.76 11.73 8.73 11.89 13.48 7.88 8.24 8.25 11.53 11.00 14.78 16.07 12.46 13.12 10.70 10.40 14.03 12.46 12.98 13.06 12.93 11.48 13.26 具 Eo典 23.10 18.27 29.89 29.96 30.02 23.2 13.9 14.8 19.8 19.84 20.03 28.2 25.9 25.9 18.88 18.61 19.6 21.25 24.34 15.9 16.6 16.6 21.2 20.5 15.9 19.7 21.6 23.0 24.21 20.4 28.8 13.7 14.5 18.3 14.8 22.7 19.69 具 Ed典 81 78 90 73 94 97 62 76 00 56 62 11 95 95 97 83 87 99 01 97 97 97 97 00 97 96 62 62 62 91 90 98 62 00 00 98 82 97 Year JCRGAE JAPAIU APOPAI APOPAI JOBPDE JOBPDE Ref. 1 JOSAAH CRTEDF NJMMAW Ref. 1 ZEKRDZ OMATET OMATET OMATET ZEKRDZ JAPIAU SSCOA4 CRTEDF JOBPDE OMATET APOPAI OMATET CRTEDF JOBPDE OMATET Ref. 1 Ref. 1 Ref. 1 PSSABA OPCOB8 CHSCBU Ref. 1 CRTEDF JJAPA5 JCRGAE ZEKRDZ JOBPDE Coden 54 49 29 12 11 14 Rf 66 35 1956 Rf 48 4 4 8 165 62 109 36 14 8 36 8 35 14 5 Rf Rf Rf 125 77 43 Rf 35 39 191 161 14 Vol 546 4223 1281 941 2252 3299 226 72 1151 265 2969 473 669 669 185 91 1968 249 119 3299 215 8587 215 1361 2238 105 688 250 250 671 221 1973 2578 1151 L1164 492 157 3299 Page 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 5 1 1 6 6 6 1 1 8 1 1 1 1 1 1 1 1 1 1 1 1 M 1 1 1 1 5 1 1 2 1 1 1 1 1? 1 4 3 1 1 1 1 4 3 3 1 1 3 1 2 2 1 1 1? 1 1 1 1 1 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 940 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions 1.6991 1.6981 1.6976 1.6974 1.6978 1.7002 1.7008 1.6989 1.7045 1.6985 1.7014 1.7010 1.7006 1.6992 1.6994 1.6997 1.7108 1.7102 1.7130 1.6994 1.6977 1.6986 1.7095 1.7107 1.7086 1.710 1.7282 1.7725 1.8113 1.8087 1.8093 1.8095 1.8084 1.8363 1.8327 1.8279 1.8184 1.6991 1.6981 1.6976 1.6974 1.6978 1.7002 1.7008 1.6989 1.7045 1.6985 1.7014 1.7010 1.7006 1.6992 1.6994 1.6997 1.7108 1.7102 1.7130 1.6994 1.6977 1.6986 1.7095 1.7107 1.7086 1.710 1.7282 1.7725 1.8113 1.8087 1.8093 1.8095 1.8084 1.8363 1.8327 1.8279 1.8184 spinel, blue-gray 共Sri Lanka兲 Mg1.00Al1.99Fe.02O*⫹ 4 spinel, pink 共Tanzania兲 Mg1.00Al1.99Fe.02O*⫹ 4 spinel, pink 共Tanzania兲 Mg.97Al2.01Fe.01O*⫹ 4 spinel, colorless 共unknown source兲 Mg1.00Al2.00O*⫹ 4 spinel, colorless 共Union Carbide兲 Mg.98Fe.01Al2.01O*⫹ 4 spinel 共Siberia兲 MgAl2 O*⫹ 4 spinel 共Linde兲 MgAl2 O⫹ 4 spinel, red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, dark-red 共Ceylon兲 MgAl2 O⫹ 4 spinel, brown 共Ceylon兲 MgAl2 O⫹ 4 spinel, brown 共Ceylon兲 MgAl2 O*⫹ 4 spinel 共0.001% Co兲 MgAl2 O*⫹ 4 spinel 共0.1% Co兲 MgAl2 O*⫹ 4 spinel 共1.15% Co兲 MgAl2 O*⫹ 4 spinel 共Schott兲 MgAl2 O*⫹ 4 spinel 共Kodak兲 MgAl2 O*⫹ 4 spinel 共General Dynamics兲 Mg.41Al2.39O*⫹ 4 spinel, colorless 共A. Mellor兲 Mg.41Al2.39O*⫹ 4 spinel, dark-blue 共A兲 Mg.38Al2.41O*⫹ 4 spinel, blue 共B兲 Mg.348Al2.435O*⫹ 4 spinel Mg.66Zn.34Fe.04Al1.96O*4 ⫹ spinel, blue 共Ceylon兲 Zn.92Fe.07Mg.01Al1.97Fe.03O*⫹ 4 gahnite 共Jos, Nigeria兲 *⫹ Y3 Al5 O12 *⫹ Y3 Al5 O12 *⫹ Y3 Al5 O12 *⫹ Y3 Al5 O12 *⫹ Y3 Al5 O12 *⫹ Dy3 Al5 O12 *⫹ Ho3 Al5 O12 *⫹ Er3 Al5 O12 *⫹ Lu3 Al5 O12 Mg1.00Al1.98Fe.02O*⫹ 4 ny nx Chemical composition, sample designations 1.8113 1.8087 1.8093 1.8095 1.8084 1.8363 1.8327 1.8279 1.8184 1.7725 1.7107 1.7086 1.710 1.7282 1.7002 1.7008 1.6989 1.7045 1.6985 1.7014 1.7010 1.7006 1.6992 1.6994 1.6997 1.7108 1.7102 1.7130 1.6994 1.6977 1.6986 1.7095 1.6978 1.6974 1.6976 1.6981 1.6991 nz 1.8352 1.8326 1.8323 1.8328 1.8324 1.8613 1.8567 1.8522 1.8423 1.7944 1.7269 1.7251 1.727 1.7465 1.7173 1.7179 1.7165 1.7219 1.7154 1.7187 1.7179 1.7174 1.7160 1.7161 1.7167 1.7274 1.7271 1.7285 1.7161 1.7154 1.7153 1.7261 1.7150 1.7142 1.7146 1.7151 1.7164 nDx 1.8352 1.8326 1.8323 1.8328 1.8324 1.8613 1.8567 1.8522 1.8423 1.7944 1.7269 1.7251 1.727 1.7465 1.7173 1.7179 1.7165 1.7219 1.7154 1.7187 1.7179 1.7174 1.7160 1.7161 1.7167 1.7274 1.7271 1.7285 1.7161 1.7154 1.7153 1.7261 1.7150 1.7142 1.7146 1.7151 1.7164 nDy 1.8352 1.8326 1.8323 1.8328 1.8324 1.8613 1.8567 1.8522 1.8423 1.7944 1.7269 1.7251 1.727 1.7465 1.7173 1.7179 1.7165 1.7219 1.7154 1.7187 1.7179 1.7174 1.7160 1.7161 1.7167 1.7274 1.7271 1.7285 1.7161 1.7154 1.7153 1.7261 1.7150 1.7142 1.7146 1.7151 1.7164 nDz 216.50 216.50 216.50 216.50 216.50 218.00 216.80 215.00 211.30 66.40 63.66 63.71 63.35 66.02 66.31 66.00 66.00 66.00 66.00 66.00 65.93 66.00 66.00 66.00 66.00 66.00 66.00 66.00 66.01 66.01 66.01 63.44 65.98 66.11 66.11 66.11 66.14 Vm 18.04 18.04 18.04 18.04 18.04 18.17 18.07 17.92 17.60 16.60 15.92 15.93 15.83 16.50 16.58 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 16.50 15.86 16.49 16.53 16.53 16.53 16.53 Vo 22.323 22.271 22.283 22.287 22.265 22.980 22.782 22.498 21.926 6.603 5.943 5.934 5.910 6.279 6.120 6.095 6.082 6.120 6.080 6.099 6.090 6.094 6.084 6.086 6.088 6.162 6.158 6.177 6.087 6.075 6.081 5.915 6.073 6.083 6.084 6.087 6.097 具 ␣ e典 0.0056 0.0056 0.0054 0.0054 0.0057 0.0055 0.0053 0.0055 0.0055 0.0056 0.0051 0.0052 0.0055 0.0054 0.0055 0.0055 0.0057 0.0055 0.0054 0.0055 0.0054 0.0054 0.0054 0.0054 0.0055 0.0052 0.0053 0.0048 0.0054 0.0057 0.0054 0.0052 0.0056 0.0055 0.0055 0.0055 0.0056 具A典 0.4384 0.4403 0.4398 0.4395 0.4406 0.4216 0.4239 0.4271 0.4335 0.4667 0.5190 0.5210 0.5201 0.5033 0.5288 0.5283 0.5301 0.5249 0.5305 0.5277 0.5282 0.5285 0.5299 0.5297 0.5294 0.5189 0.5196 0.5170 0.5297 0.5313 0.5305 0.5202 0.5312 0.5316 0.5314 0.5309 0.5299 具B典 11.19 11.18 11.39 11.39 11.12 11.08 11.28 11.18 11.22 11.50 12.80 12.70 12.26 12.21 12.41 12.42 12.23 12.32 12.48 12.34 12.46 12.50 12.50 12.52 12.43 12.65 12.51 13.11 12.54 12.17 12.50 12.65 12.32 12.47 12.41 12.44 12.33 具 Eo典 25.5 25.4 25.9 25.9 25.2 26.2 26.6 26.1 25.8 24.64 24.66 24.38 23.58 24.26 23.47 23.51 23.07 23.47 23.53 23.38 23.59 23.66 23.59 23.65 23.47 24.37 24.09 25.36 23.68 22.91 23.57 24.33 23.19 23.46 23.36 23.43 23.26 具 Ed典 65 86 89 97 81 97 97 81 81 97 97 97 61 37 97 78 62 62 62 62 62 62 62 62 62 62 62 62 91 91 91 97 97 97 97 97 97 Year JAPIAU Ref. 3 SPHCA6 JOBPDE INOMAF JOBPDE JOBPDE INOMAF INOMAF JOBPDE JOBPDE JOBPDE ACELAZ MNLMBB JOBPDE Ref. 7 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 9 Ref. 9 Ref. 9 JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE Coden 34 14 17 14 14 17 17 36 14 14 14 6 24 14 Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf 14 14 14 14 14 14 Vol 1674 120 712 3299 308 3299 3299 308 308 3299 3299 3299 120 547 3299 7-106 244 267 267 267 267 267 267 155 155 173 173 173 883 883 883 3299 3299 3299 3299 3299 3299 Page 1 1 1 1 1 1 1 1 1 1 1 1 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 M 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1? 1 1 1 1 1 1 1 1 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 941 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions *⫹ Y2.93Nd.07Sc2 Al3 O12 * Gd3 Sc2 Al3 O12 CaYAlO*⫹ 4 CaYAlO*⫹ 4 CaNdAlO*⫹ 4 SrLaAlO*⫹ 4 * SrLaAlO4 SrLaAl.75Ga.25O*4 * La.8Nd.2MgAl11O19 Gallates LiGaO*⫹ 2 LiGaO*2 LaGaO*3 IR FL NdGaO*3 IR FL CoGa2 O*4 关IR, not accurate兴 * Y3 Ga5 O12 * Y3 Ga5 O12 *⫹ Nd3.01Ga4.99O12 *⫹ Nd3 Ga5 O12 *⫹ Sm3.02Ga4.98O12 *⫹ Eu3.02Ga4.98O12 *⫹ Gd3 Ga5 O12 *⫹ Gd3 Ga5 O12 *⫹ Gd3 Ga5 O12 *⫹ Gd3.03Ga4.97O12 *⫹ Gd3 Ga5 O12 共BTL兲 *⫹ Tb3.04Ga4.96O12 *⫹ 共Allied Signal兲 Tb3.04Ga4.96O12 * Tb3 Ga5 O12 *⫹ Dy3.05Ga4.95O12 *⫹ Ho3.06Ga4.94O12 * Tm3 Ga5 O12 *⫹ Y3 Sc2 Ga3 O12 *⫹ Nd3 Sc2 Ga3 O12 *⫹ Sm3 Sc2 Ga3 O12 *⫹ Gd3 Sc2 Ga3 O12 *⫹ La3 Lu2 Ga3 O12 *⫹ La2.7Lu2.3Ga3 O12 *⫹ La1.3GdLu2.7Ga3 O12 *⫹ Nd3 Lu2 Ga3 O12 *⫹ Y2.545Er.455Ga1.977Cr.023Ga3 O12 * Gd2.96Nd.04Ga4.8Al.2O12 * Gd2.964Nd.036Ga4 AlO12 *⫹ Y1.5Er1.5Al5 O12 Chemical composition, sample designations 1.8198 1.8515 1.87 1.8767 1.8757 1.9266 1.9316 1.92 1.92 1.771 1.7061 1.730 2.02 2.02 2.00 1.878 1.882 1.9470 1.9476 1.9452 1.9407 1.9328 1.9330 1.9326 1.9332 1.9334 1.9325 1.9335 1.932 1.9311 1.9281 1.9187 1.9068 1.9300 1.9410 1.9315 1.9187 1.9186 1.9200 1.9295 1.9097 1.929 1.909 1.7061 1.705 2.02 2.02 2.00 1.878 1.882 1.9470 1.9476 1.9452 1.9407 1.9328 1.9330 1.9326 1.9332 1.9334 1.9325 1.9335 1.932 1.9311 1.9281 1.9187 1.9068 1.9300 1.9410 1.9315 1.9187 1.9186 1.9200 1.9295 1.9097 1.929 1.909 ny 1.8198 1.8515 1.87 1.8767 1.8757 1.9266 1.9316 1.92 1.92 1.771 nx 1.7339 1.734 2.02 2.02 2.00 1.878 1.882 1.9470 1.9476 1.9452 1.9407 1.9328 1.9330 1.9326 1.9332 1.9334 1.9325 1.9335 1.932 1.9311 1.9281 1.9187 1.9068 1.9300 1.9410 1.9315 1.9187 1.9186 1.9200 1.9295 1.9097 1.929 1.909 1.8198 1.8515 1.87 1.8990 1.8978 1.9513 1.9516 1.95 1.94 1.764 nz 1.7350 1.763 1.919 1.916 1.9871 1.9872 1.9840 1.9794 1.9698 1.9698 1.9693 1.9699 1.9702 1.9707 1.9710 1.971 1.9679 1.9638 1.9582 1.9417 1.9671 1.9797 1.9687 1.9564 1.9561 1.9575 1.9695 1.9444 1.964 1.944 1.919 1.916 1.9871 1.9872 1.9840 1.9794 1.9698 1.9698 1.9693 1.9699 1.9702 1.9707 1.9710 1.971 1.9679 1.9638 1.9582 1.9417 1.9671 1.9797 1.9687 1.9564 1.9561 1.9575 1.9695 1.9444 1.964 1.944 1.8432 1.8795 1.90 1.9077 1.9068 1.9620 1.9663 1.95 1.96 1.791 nDy 1.7350 1.735 1.8432 1.8795 1.90 1.9077 1.9068 1.9620 1.9663 1.95 1.96 1.791 nDx 1.919 1.916 1.9871 1.9872 1.9840 1.9794 1.9698 1.9698 1.9693 1.9699 1.9702 1.9707 1.9710 1.971 1.9679 1.9638 1.9582 1.9417 1.9671 1.9797 1.9687 1.9564 1.9561 1.9575 1.9695 1.9444 1.964 1.944 1.7654 1.765 1.8432 1.8795 1.90 1.9290 1.9280 1.9867 1.9865 1.97 1.99 1.783 nDz 21.54 21.54 19.57 19.19 18.12 19.27 19.27 20.39 20.37 20.02 19.90 19.77 19.77 19.77 19.77 19.77 19.61 19.61 19.61 19.48 19.37 19.16 19.15 21.23 21.03 20.67 22.87 22.78 22.52 19.72 19.51 236.67 234.16 17.96 19.24 19.88 19.72 19.72 20.57 22.29 22.29 22.51 15.60 Vo 43.08 43.08 58.70 57.56 72.50 231.31 231.31 244.70 244.49 240.50 238.80 237.30 237.30 237.30 237.30 237.30 235.40 235.40 235.40 233.80 232.40 230.00 229.80 254.80 252.40 248.10 274.43 273.40 270.20 215.50 230.90 238.60 78.88 78.88 82.30 89.15 89.15 90.06 296.44 Vm 26.873 26.189 4.042 4.075 7.099 6.962 8.654 25.247 25.328 28.154 28.142 27.634 27.349 27.020 27.024 27.016 27.028 27.032 26.798 26.818 26.788 26.588 26.370 25.915 25.658 28.953 28.913 28.223 30.921 30.802 30.474 22.390 24.658 25.874 8.652 8.645 9.385 10.192 10.130 10.208 29.369 具 ␣ e典 0.0080 0.0065 0.0067 0.0066 0.0065 0.0065 0.0064 0.0063 0.0063 0.0063 0.0063 0.0066 0.0064 0.0066 0.0063 0.0062 0.0070 0.0064 0.0064 0.0065 0.0064 0.0067 0.0067 0.0066 0.0069 0.0063 0.0061 0.0063 0.0090 0.0092 0.0054 0.0059 0.0066 0.0059 0.0060 0.0061 0.0059 0.0039 0.0073 0.0052 具A典 0.3960 0.3933 0.3583 0.3580 0.3592 0.3615 0.3655 0.3654 0.3656 0.3653 0.3652 0.3657 0.3651 0.3659 0.3664 0.3680 0.3729 0.3794 0.3670 0.3613 0.3662 0.3729 0.3730 0.3722 0.3672 0.3778 0.3676 0.3779 0.5150 0.5080 0.4326 0.4119 0.3999 0.3922 0.3929 0.3646 0.3628 0.3646 0.3694 0.4696 具B典 8.90 9.83 9.28 9.33 9.43 9.40 9.59 9.60 9.62 9.62 9.62 9.45 9.54 9.40 9.61 9.73 9.24 9.75 9.57 9.41 9.56 9.44 9.47 9.49 9.22 9.78 9.79 9.81 9.57 9.39 11.33 10.55 9.81 10.27 10.24 9.80 9.90 12.25 8.97 12.04 具 Eo典 22.4 24.9 25.9 26.0 26.2 26.0 26.2 26.2 26.3 26.3 26.3 25.8 26.1 25.6 26.2 26.4 24.7 25.6 26.0 26.0 26.0 25.3 25.3 25.4 25.10 25.89 26.6 25.9 18.58 18.48 26.2 25.6 24.5 26.19 26.05 26.87 27.28 33.59 24.27 25.6 具 Ed典 70 65 94 94 78 87 74 97 84 97 97 87 78 89 97 90 97 97 94 97 97 82 97 84 97 87 89 89 89 84 89 88 88 97 97 73 97 97 97 97 96 96 83 Year JAPIAU APOPAI JOBPDE JOBPDE SPSSA7 Ref. 5 PLRBAQ JOBPDE SPHCA6 JOBPDE JOBPDE Ref. 5 KRTEAW SPHCA6 JOBPDE APOPAI JOBPDE JOBPDE PSSBBD JOBPDE JOBPDE JCRGAE JOBPDE SPHCA6 JOBPDE Ref. 5 SPHCA6 SPHCA6 SPHCA6 SPHCA6 SPHCA6 JCRGAE JCRGAE JOBPDE JOBPDE JAPIAU JOBPDE JOBPDE JOBPDE JOBPDE PSSBBD PSSBBD SJQEAF Coden 34 34 34 29 34 92 92 13 34 14 29 14 14 182 14 14 57 14 29 14 10 14 29 14 14 41 4 11 11 20 14 14 44 14 14 14 14 195 195 13 Vol 3008 1036 2252 2252 1451 314 971 3299 704 3299 3299 307 K10 712 3299 3704 3299 3299 K91 3299 3299 600 3299 704 3299 308 712 712 712 704 712 17 17 3299 3299 1395 3299 3299 3299 3299 625 625 1082 Page 1 5 03 03 03 8 1 1 1 1 1 1 1 1 1 1 1 1 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6 1 1 1 1 8 8 5 M 2 3 5 5 5 3? 3 1 2 1 1 1 1 1 1 1 1 1 3 1 1 3? 1 2 1 1 1 1 1 2 1 3 3 1 1 5? 1 1 1 1 5? 5 3 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 942 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Ferrites MnFe2 O*4 CoFe2 O4 ZnFe2 O*4 *⫹ 共BTL兲 Y3 Fe5 O12 * Y3 Fe5 O12 * Y3 Fe5 O12 * films Y3 Fe5 O12 Silicates Be2 SiO*⫹ 4 phenacite Be2 SiO*⫹ 4 phenacite Be2 SiO*4 phenacite Mg2 SiO*⫹ 4 forsterite 共synthetic兲 Mg2 SiO⫹ 4 共Fayal兲, contains Fe? Mg1.80Fe.225Ni.01SiO*⫹ 4 peridot 共San Carlos, AZ兲 Mg2 SiO*4 forsterite 共synthetic兲 Mn1.98Si1.00O*⫹ 4 tephroite 共synthetic兲 Mn2 SiO*4 tephroite 共synthetic兲 Mn1.85Mg.15SiO*4 tephroite 共Pajsberg兲 Fe2 SiO*⫹ 4 fayalite 共Oberharz兲 Fe1.72Mn.09Mg.16Ca.03Si.98Ti.02O*⫹ 4 fayalite 共Cuddia Mida, Isola de Pantelleria, It.兲 Fe2 SiO*⫹ 4 fayalite 共synthetic-O. Kopp, C. Finch兲 Fe2 SiO*⫹ 4 fayalite 共synthetic-O. Kopp, C. Finch兲 ⫹ Fe2 SiO*⫹ 4 fayalite 共8A1 8C2兲 *⫹ ⫹ Fe2 SiO4 fayalite 共8C2 8B1兲 Zn2 SiO4 -alpha*⫹ willemite 共Altenberg near Aachen兲 Zn2 SiO4 willemite *⫹ Gd2.286Er.714Ga1.976Cr.024Ga3 O12 *⫹ Nd2.7Yb2.3Ga3 O12 *⫹ LaEr3 ScGa3 O12 *⫹ La2.37Nd.07Pb.01Lu2.54Cr.01Ga3 O12 *⫹ La2.37Nd.07Pb.01Lu2.54Cr.01Ga3 O12 SrLaGa3 O*⫹ 7 SrGdGa3 O*7 BaLaGa3 O*7 *⫹ La3 Ga5 SiO14 *⫹ La3 Ga5 GeO14 *⫹ La3 Ga5.5Nb.5O14 *⫹ La3 Ga5.5Ta.5O14 Chemical composition, sample designations 1.631 1.7803 1.768 1.760 1.8289 1.8006 1.8311 1.8306 1.8306 1.8306 1.6661 1.6728 1.7933 1.7924 1.7923 1.7927 1.6661 1.6728 1.6403 1.6392 1.66 1.6353 1.6717 1.6569 1.6403 1.6392 1.66 1.6211 1.6529 1.6407 1.651 1.7545 1.739 1.737 1.7918 1.7708 2.18 2.480 2.16 2.1287 2.165 2.15 2.17 1.9319 1.9329 1.9422 1.9188 1.9239 1.7947 1.793 1.845 1.8712 1.8875 1.9122 1.9055 ny 2.18 2.480 2.16 2.1287 2.165 2.15 2.17 1.9319 1.9329 1.9422 1.9188 1.9239 1.7947 1.793 1.845 1.8712 1.8875 1.9122 1.9055 nx 1.7020 1.8411 1.8406 1.6940 1.8410 1.8414 1.668 1.7937 1.778 1.770 1.8429 1.8085 1.6559 1.6561 1.66 1.6530 1.6902 1.6758 2.18 2.480 2.16 2.1287 2.165 2.15 2.17 1.9319 1.9329 1.9422 1.9188 1.9239 1.7831 1.810 1.850 1.8829 1.9005 1.9397 1.9298 nz 1.6939 1.8253 1.8254 1.6893 1.8253 1.8258 1.6939 1.8660 1.8660 1.6893 1.8660 1.8664 1.8092 1.806 1.787 1.8662 1.8368 1.6506 1.6897 1.6744 1.6358 1.6702 1.6569 1.7809 1.774 1.761 1.8246 1.8031 1.6538 1.6536 1.6538 1.6536 2.3266 2.485 2.31 2.34 1.9043 1.9249 1.9543 1.9434 1.9043 1.9249 1.9543 1.9434 2.3266 2.485 2.31 2.34 1.9684 1.9722 1.9668 1.9561 1.9616 1.8287 1.836 nDy 1.9684 1.9722 1.9668 1.9561 1.9616 1.8287 1.836 nDx 1.7230 1.8747 1.8749 1.7179 1.8748 1.8752 1.8219 1.816 1.799 1.8782 1.8447 1.6687 1.7086 1.6934 1.6696 1.6693 2.3266 2.485 2.31 2.34 1.9157 1.9377 1.9846 1.9699 1.9684 1.9722 1.9668 1.9561 1.9616 1.8182 1.842 nDz 87.02 76.92 76.92 87.02 76.92 76.92 72.48 81.33 81.33 81.33 77.53 77.53 61.73 61.73 61.73 72.48 72.48 73.06 21.75 19.23 19.23 21.75 19.23 19.23 18.12 20.33 20.33 20.33 19.38 19.38 15.43 15.43 15.43 18.12 18.12 18.27 19.18 18.49 18.74 19.74 19.74 19.74 19.74 22.51 22.51 24.78 23.93 25.49 20.96 21.21 21.40 21.43 270.20 270.20 173.45 167.50 178.40 293.48 296.91 299.56 300.13 76.74 73.98 74.96 236.90 236.90 236.90 236.90 22.13 Vo 265.60 Vm 7.874 8.003 8.002 7.809 8.003 8.007 6.311 8.116 8.003 7.955 8.065 7.863 5.346 5.341 5.440 6.207 6.476 6.422 10.181 11.161 9.841 30.578 31.184 30.936 31.266 30.446 30.564 17.551 17.073 18.973 31.958 32.767 33.820 33.686 30.245 具 ␣ e典 0.0071 0.0077 0.0077 0.0081 0.0077 0.0076 0.0071 0.0098 0.0072 0.0079 0.0085 0.0060 0.0063 0.0063 0.0052 0.0054 0.0197 0.0271 0.0159 0.0157 0.0065 0.0071 0.0075 0.0069 0.0063 0.0068 0.0042 0.0066 0.0066 0.0084 0.0094 具A典 0.5464 0.4321 0.4318 0.5537 0.4319 0.4315 0.4644 0.4758 0.4805 0.4320 0.4516 0.5962 0.5577 0.5723 0.5857 0.5864 0.2832 0.2711 0.2767 0.2696 0.3975 0.3878 0.3716 0.3758 0.3660 0.3655 0.3607 0.3729 0.3702 0.4531 0.4475 具B典 11.08 9.46 9.50 10.48 9.48 9.51 10.21 8.82 10.35 9.34 9.24 12.61 11.92 12.08 13.43 13.22 4.80 4.00 5.27 5.24 9.88 9.38 8.88 9.31 9.64 9.31 11.71 9.49 9.47 9.30 8.71 具 Eo典 20.28 21.90 21.99 18.93 21.96 22.04 21.99 18.53 21.53 21.63 20.47 21.14 21.38 21.11 22.93 22.54 16.9 14.7 19.0 19.4 24.8 24.1 23.8 24.7 26.34 25.4 32.46 25.4 25.5 20.5 19.4 具 Ed典 62 97 97 23 97 97 73 97 32 62 62 09 62 62 73 28 28 97 89 78 89 97 65 74 73 89 84 84 97 97 96 91 84 83 87 87 87 Year Ref. 1 JOBPDE JOBPDE ZEKRDZ JOBPDE JOBPDE PSSBBD JOBPDE AMMIAY Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 PSSBBD AMMIAY AMMIAY JOBDE PSSBBD SPSSA7 PSSBBD JOBPDE BJAPAJ PLRBAQ APPLAB SPHCA6 SPHCA6 SPHCA6 JOBPDE JOBPDE JOBPDE JOBPDE PHBCDQ PSSABA SPHCA6 SPHCA6 SPHCA6 Coden Rf 14 14 58 14 14 55 14 17 Rf Rf 46 Rf Rf 55 13 13 14 152 20 152 14 16 10 23 34 29 29 14 14 13 8 123 80 32 32 32 Vol 2883 3299 3299 460 3299 3299 677 3299 135 1236 1390 138 2688 2903 143 559 559 3299 657 1451 657 3299 475 971 702 712 704 704 3299 3299 1941 1668 215 387 236 236 236 Page 1 1 1 1 1 1 3 1 2 1 1 1 1 1 3 1 1 1 3 3 3 1 1 6 7 1 1 1 1 1 1 1 8 1 1 1 1 M 1 1 1 1? 1 1 3 1 3? 3 1 1? 1 1 4 1 1? 1 5 5 5 2 3? 5 5 1 2 2? 1 1 2 3? 6 2 1 1 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E O and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 943 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions CaMnSiO*4 共synthetic兲 Ca1.22Fe.40Mn.24Mg.14SiO*⫹ 4 monticellite 共Gute-HoffnungshXtte兲 Ca.82Fe1.02Mg.10Zn.06SiO*⫹ 4 olivine 共Clausthaler Silberhütte兲 Sr2 SiO*4 monoclinic 共synthetic兲 FL 367 K Eu2 SiO4 -beta* monoclinic *⫹ trimerite CaMn1.69Fe.24Mg.07Be3 Si3 O12 共Harstigsgrube兲 ZrSiO⫹ 4 zircon, colorless 共Chantaboon, Thailand兲 ZrSiO⫹ 4 zircon ZrSiO*⫹ 4 zircon, blue 共Chantaboon, Thailand兲 ZrSiO⫹ 4 zircon 共unknown source兲 ZrSiO4 zircon Zr.99Hf.01SiO*⫹ 4 zircon 共Nigeria?兲 ZrSiO*4 zircon, red-brown 共North Burgess, Ontario兲 Al2 SiO*⫹ 5 kyanite Al2 SiO5 andalusite 共Brazil兲 Al2 SiO⫹ 5 sillimanite, pale-blue 共Mogok, Upper Burma兲 Al2 SiO⫹ 5 sillimanite 共Ceylon兲 Al2 SiO5 sillimanite Y2 SiO5 :Nd*⫹ Al2 SiO4 F*⫹ 2 topaz 共Schneckenstein兲 Al2 SiO4 F*⫹ 2 topaz Al2 SiO4 F2 topaz *⫹ topaz Al2 SiO4 F1.89共OH兲.11 *⫹ topaz Al2 SiO4 F1.89共OH兲.11 *⫹ Bi4 Si3 O12 *⫹ Bi4 Si3 O12 CaBSiO4 OH*⫹ datolite 共Serra dei Zanchetti兲 CaBSiO4 OH*⫹ datolite 共Westfield, MA兲 Ca.95 Mg.05B2 Si2 O*⫹ 8 danburite 共Okira, Japan兲 Ca1.00B1.99Al.01Si2.00O*⫹ 8 danburite 共Charcus, Mexico兲 Cu6Si6O18•6 H2O⫹ dioptase Cu6Si6O18•6 H2O⫹ dioptase 共Kirgensteppe兲 Pb9Mg9Si9O24共OH兲24 molybdophyllite 共Langbanshuttan, Varmland, Sweden兲 Pb3Al2CaSi10O27•3 H2O*⫹ wickenburgite 共Wickenburg, AZ兲 Chemical composition, sample designations 1.6851 1.6826 1.7090 1.707 1.817 1.7020 1.8911 1.8819 1.8942 1.8898 1.8948 1.8939 1.908 1.7053 1.6257 1.6443 1.6425 1.6426 1.7655 1.6063 1.6217 1.6036 1.6031 1.6023 1.9674 1.9559 1.6377 1.6383 1.6200 1.6192 1.6338 1.6291 1.7836 1.6550 1.6743 1.702 1.813 1.6990 1.8911 1.8819 1.8942 1.8898 1.8948 1.8939 1.908 1.6984 1.6197 1.6426 1.6408 1.6407 1.7629 1.6035 1.6191 1.6009 1.5998 1.5992 1.9674 1.9559 1.6109 1.6121 1.6167 1.6166 1.6338 1.6291 1.7836 1.6550 ny 1.6570 1.6554 nx 1.6183 1.6800 1.6720 1.7309 1.6227 1.6610 1.6600 1.7851 1.6131 1.6303 1.6104 1.6094 1.6096 1.9674 1.9559 1.6544 1.6550 1.6226 1.7114 1.6293 1.6613 1.9463 1.9527 1.9519 1.956 1.9433 1.9519 1.9508 1.736 1.841 1.7100 1.7189 1.6974 1.6857 nz 1.6911 1.6573 1.6611 1.8145 1.6299 1.6563 1.6576 1.7865 1.6153 1.6293 1.6120 1.6112 1.6107 2.0293 2.0217 1.6246 1.6253 1.6302 1.7130 1.6327 1.6581 1.9254 1.9262 1.9256 1.936 1.9195 1.9255 1.9239 1.727 1.889 1.7155 1.6957 1.6861 1.6744 nDx 1.6911 1.6573 1.6809 1.8145 1.6327 1.6577 1.6592 1.7894 1.6179 1.6308 1.6146 1.6142 1.6136 2.0293 2.0217 1.6527 1.6530 1.6333 1.7221 1.6387 1.6593 1.9254 1.9262 1.9256 1.936 1.9195 1.9255 1.9239 1.732 1.896 1.7192 1.7339 1.7117 1.7043 nDy 1.6478 1.7091 1.6886 1.7609 1.6361 1.6766 1.6797 1.8104 1.6248 1.6379 1.6215 1.6208 1.6209 2.0293 2.0217 1.6694 1.6697 1.6361 1.7287 1.6439 1.6785 1.9796 1.9841 1.9847 1.990 1.9803 1.9843 1.9838 1.756 1.914 1.7255 1.7431 1.7217 1.7095 nDz 635.17 476.77 476.77 1043.38 136.33 82.92 82.92 106.90 85.84 85.84 85.84 85.84 85.84 273.10 273.10 88.59 88.59 136.30 73.29 85.54 82.92 65.94 65.94 65.32 65.94 65.94 65.94 65.94 97.59 97.77 214.61 87.60 89.06 Vm 21.17 19.86 19.86 21.74 17.04 16.58 16.58 21.38 14.30 14.30 14.30 14.30 14.30 22.76 22.76 17.72 17.72 17.04 14.65 17.11 16.58 16.49 16.49 16.33 16.49 16.49 16.49 16.49 24.40 24.44 17.88 21.90 22.26 Vo 54.820 41.475 41.181 103.106 11.425 7.204 7.201 10.617 7.083 7.233 7.058 7.049 7.046 31.881 31.623 7.566 7.574 11.427 6.800 7.219 7.215 7.373 7.404 7.329 7.459 7.337 7.400 7.386 9.153 10.193 19.882 8.089 8.033 具 ␣ e典 0.0127 0.0094 0.0066 0.0080 0.0056 0.0059 0.0067 0.0063 0.0051 0.0037 0.0049 0.0050 0.0050 0.0096 0.0104 0.0058 0.0056 0.0056 0.0051 0.0056 0.0060 0.0064 0.0057 0.0058 0.0054 0.0069 0.0057 0.0060 0.0072 0.0162 0.0053 0.0075 0.0090 0.0074 具A典 0.5893 0.5822 0.5711 0.4726 0.6162 0.5828 0.5832 0.4680 0.6312 0.6110 0.6346 0.6357 0.6363 0.3483 0.3539 0.5990 0.5981 0.6159 0.5244 0.6097 0.5813 0.3788 0.3759 0.3764 0.3705 0.3823 0.3762 0.3776 0.5155 0.4300 0.5258 0.5289 0.5493 0.5546 具B典 8.62 9.96 11.79 9.70 13.26 12.61 11.81 10.88 14.07 16.31 14.44 14.29 14.20 7.62 7.37 12.89 13.04 13.23 12.77 13.24 12.45 9.75 10.29 10.17 10.51 9.40 10.24 10.04 10.72 6.52 12.60 10.64 9.86 10.93 具 Eo典 14.6 17.1 20.6 20 21.5 21.64 20.26 23.2 22.28 26.69 22.75 22.48 22.32 21.8 20.8 21.51 21.80 21.4 24.35 21.72 21.41 25.74 27.37 27.02 28.37 24.59 27.22 26.60 20.80 15.17 23.9 20.11 17.94 19.71 具 Ed典 68 62 62 38 97 62 62 90 62 62 62 97 97 72 95 62 97 62 62 08 62 03 10 97 62 62 62 62 22 71 60 62 32 62 Year AMMIAY Ref. 1 Ref. 1 Ref. 10C JOBPDE Ref. 1 Ref. 1 IEJQA7 Ref. 1 Ref. 1 Ref. 1 JOBPDE JOBPDE JAPIAU OPSUA3 Ref. 1 JOBPDE Ref. 1 Ref. 1 ZEKRDZ Ref. 1 ZEKRDZ ZEKRDZ JOBPDE Ref. 1 Ref. 1 Ref. 1 Ref. 1 AJSCAP PKOMA3 Ref. 10D Ref. 1 AMMIAY Ref. 1 Coden 53 Rf Rf 14 Rf Rf 26 Rf Rf Rf 14 14 43 79 Rf 14 Rf Rf 44 Rf 37 47 14 Rf Rf Rf Rf 4 14 Rf 17 Rf Vol 1433 621 2889 368 3299 4038 4085 1405 4046 4071 1833 3299 3299 5110 868 2950 3299 1044 4085 313 1520 235 1 3299 647 514 595 514 331 37 871 1082 135 843 Page 2 1 1 1 1 1 1 5 1 1 1 1 1 1 6 1 1 1 1 1 1 1 1 1 1 1 1 1 2 6 1 1 2 1 M 2 1 1? 1? 1 1 1? 1 1 1? 1 1 1 1 2 1 1 1 1 2 1 1? 1 1 3 1? 1 1 3 3 1 1 3? 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 944 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions *⫹ Be3.0Al1.96Cr.07Si5.96O18 *⫹ Be3.0Al1.96Cr.07Si5.96O18 beryl 共synthetic-Chatham兲 beryl 共synthetic-Chatham兲 Na.02Be3.04Al1.95Fe.02Mg.01Si5.99O18• 共.32H2 O兲*⫹ aquamarine 共Nuristan, Pakistan兲 Na.04Cs.02Be3.06Al1.96Fe.02Zn.01Si5.97O18• 共.41H2 O兲*⫹ aquamarine 共Nuristan, Pakistan兲 Na.04Be3.06Al1.93Fe.03 Mg.02Zn.01Si5.97O18•(.49H2O兲*⫹ beryl, green 共Padre Paraiso, Minas Gerais兲 Na.04Be3.06Al1.93Fe.03 Mg.02Zn.01Si5.97O18•(.49H2O兲*⫹ beryl, green 共Padre Paraiso, Minas Gerais兲 Na.03Cs.04Be3.05Al1.97 Fe.01Si5.97O18•共.46H2O兲*⫹ goshenite 共Hunza, Pakistan兲 Na.20Cs.14Be3.15Al1.90 Si5.90V.01O18•共.88H2O兲*⫹ morganite 共Brazil兲 Li.37Na.24Cs.11Mg.04 Be2.58B.06Al2.02Si5.94O18.共67H2O兲*⫹ beryl, Maxize 共Minas Gerais兲 *⫹ * Si5 O18•共H2O兲.49共CO2 兲.07 cordierite, blue Na.04Mg1.72Fe.27Al3.97 Fe.03 共Madagascar兲 *⫹ Na.03Mg1.97Fe.03Al3.97 Fe* .03 Si5 O18•共H2O兲.41共CO2 兲.07 cordierite, colorless 共unknown source兲 *⫹ pyrope 共Northeast AZ兲 Mg2.04Fe.53Ca.43Mn.02 Al1.96Cr.03Fe.01Si3 O12 *⫹ pyrope 共Madagascar兲 Mg1.95Fe.99Ca.09Mn.01Al1.98Si3 O12 *⫹ pyrope 共Sri Lanka兲 Mg1.64Fe1.17Ca.19Mn.03Al2 Si3 O12 *⫹ almandine 共North Creek, NY兲 Fe1.45Mg1.18Ca.20Mn.04Al2 Si3 O12 *⫹ pyrope 共Tanzania兲 Mg1.23Fe.90Mn.56Ca.33Al1.98V.02Cr.01Zn.01Si3 O12 * pyrope Mg3 Al2 Si3 O12 *⫹ spessartine 共Ramona, CA兲 Mn2.80Fe.17Ca.01Al2.03Si3 O12 (2⫹) (3⫹) *⫹ Fe.123 Al2.01Si2.98O12 spessartine 共Kenya兲 Mn2.16Ca.14Fe.512 *⫹ grossular 共Asbestos, Quebec兲 Ca2.92Mn.04Fe.135Al2 Si3 O12 Ca2.95Al1.97Mg.04Mn.01Ti.02Fe.01Si2.99O*⫹ 12 grossular 共Umba River, Tanzania兲 *⫹ grossular 共Jeffrey Quarry, Quebec兲 Ca2.98Mn.01Fe.01Al1.97Fe.02Si2.94O12 *⫹ grossular 共Passo del Termine兲 Ca2.66Mg.20Fe.14Al1.84Fe.16Si3 O12 *⫹ demantoid 共Val Malenco兲 Ca3.00Fe1.99Mg.02Al.01Si2.98O12 *⫹ demantoid 共Ala Valley兲 Ca2.99Fe2.00Mg.02Al.01Si2.98O12 *⫹ demantoid 共Val Malenco兲 Ca3.00Fe1.99Mg.02Al.01Si2.98O12 Ca3 Fe2 Si3 O12 andradite (3⫹) *⫹ Al0.04Fe0.01共SiO4 兲2.07共O4 H4 兲0.93 Ca3 Mn1.95 henritermierite, n data from O. Medenbach Li1.00Al.97Si2.02O*⫹ 6 spodumene 共Nuristan, Afghanistan兲 Li.95Na.05AlSi2 O*⫹ 6 spodumene, rose 共Maharitra, Madagascar兲 LiAlSi2 O*⫹ 6 spodumene, colorless Chemical composition, sample designations 1.5526 1.5511 1.5633 1.5650 1.5661 1.5665 1.5653 1.5794 1.5792 1.5285 1.5231 1.7219 1.7342 1.7489 1.7536 1.7511 1.730 1.7816 1.7794 1.7208 1.7232 1.7169 1.7444 1.8344 1.8347 1.8319 1.841 1.7594 1.6504 1.6509 1.6510 1.5650 1.5661 1.5665 1.5653 1.5794 1.5792 1.5227 1.5193 1.7219 1.7342 1.7489 1.7536 1.7511 1.730 1.7816 1.7794 1.7208 1.7232 1.7169 1.7444 1.8344 1.8347 1.8319 1.841 1.7594 1.6462 1.6454 1.6454 ny 1.5526 1.5511 1.5633 nx 1.6606 1.6600 1.6597 1.7169 1.7444 1.8344 1.8347 1.8319 1.841 1.8198 1.7219 1.7342 1.7489 1.7536 1.7511 1.730 1.7816 1.7794 1.7208 1.7232 1.5263 1.5312 1.5722 1.5720 1.5600 1.5609 1.5607 1.5597 1.5487 1.5477 1.5581 nz 1.6601 1.6602 1.6602 1.7339 1.7565 1.8863 1.8867 1.8855 1.889 1.7967 1.7395 1.7525 1.7678 1.7735 1.7706 1.749 1.8028 1.8018 1.7383 1.7414 1.5318 1.5358 1.5923 1.5920 1.5777 1.5788 1.5784 1.5775 1.5650 1.5633 1.5757 nDx 1.6648 1.6651 1.6649 1.7339 1.7565 1.8863 1.8867 1.8855 1.889 1.7967 1.7395 1.7525 1.7678 1.7735 1.7706 1.749 1.8028 1.8018 1.7383 1.7414 1.5357 1.5413 1.5923 1.5920 1.5777 1.5788 1.5784 1.5775 1.5650 1.5633 1.5757 nDy 1.6755 1.6759 1.6756 1.7339 1.7565 1.8863 1.8867 1.8855 1.889 1.8726 1.7395 1.7525 1.7678 1.7735 1.7706 1.749 1.8028 1.8018 1.7383 1.7414 1.5389 1.5442 1.5848 1.5844 1.5722 1.5732 1.5730 1.5721 1.5610 1.5598 1.5703 nDz 97.31 97.31 97.31 208.04 206.97 219.40 219.40 219.40 219.40 232.19 191.88 189.74 190.85 192.04 193.28 187.89 195.79 195.77 207.89 208.04 387.67 388.39 339.38 339.00 337.88 338.09 338.09 337.90 338.41 338.41 337.87 Vm 16.22 16.22 16.22 17.34 17.25 18.28 18.28 18.28 18.28 19.34 15.99 15.81 15.90 16.00 16.11 15.66 16.32 16.31 17.32 17.34 21.53 21.57 18.85 18.80 18.77 18.28 18.28 18.77 18.80 18.80 18.77 Vo 8.498 8.495 8.494 19.552 20.017 23.089 23.095 23.039 23.221 23.246 18.129 18.159 18.542 18.746 18.819 17.904 19.640 19.597 19.619 19.683 28.267 28.527 26.850 26.812 26.218 26.276 26.263 26.208 25.787 25.736 26.142 具 ␣ e典 0.0054 0.0056 0.0056 0.0052 0.0035 0.0110 0.0111 0.0115 0.0101 0.0105 0.0053 0.0053 0.0053 0.0055 0.0054 0.0055 0.0054 0.0057 0.0053 0.0055 0.0075 0.0075 0.0062 0.0062 0.0063 0.0062 0.0062 0.0063 0.0066 0.0065 0.0063 具A典 0.5780 0.5783 0.5784 0.5135 0.4895 0.4226 0.4226 0.4245 0.4183 0.4623 0.5089 0.4982 0.4857 0.4819 0.4839 0.5013 0.4599 0.4616 0.5099 0.5077 0.7580 0.7501 0.6725 0.6729 0.6922 0.6905 0.6911 0.6927 0.7110 0.7130 0.6952 具B典 13.08 12.85 12.88 12.54 15.03 7.83 7.81 7.68 8.13 8.40 12.38 12.22 12.15 11.86 11.96 12.06 11.70 11.37 12.40 12.18 12.75 12.62 13.19 13.22 13.27 13.32 13.30 13.21 13.14 13.26 13.27 具 Eo典 22.63 22.22 22.27 24.4 30.7 18.5 18.4 18.1 19.4 18.1 24.3 24.5 25.0 24.6 24.7 24.0 25.4 24.6 24.3 23.9 16.8 16.8 19.6 19.6 19.1 19.2 19.2 19.0 18.4 18.6 19.0 具 Ed典 97 13 13 97 62 97 97 97 62 00 97 97 97 97 97 62 97 78 97 97 97 97 97 35 97 97 97 97 97 97 97 Year JOBPDE ZEKRDZ ZEKRDZ JOBPDE Ref. 1 JOBPDE JOBPDE JOBPDE Ref. 1 Ref. 14 JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE Ref. 1 JOBPDE AFSLAO JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE ZMGPAS JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE Coden 14 13 13 14 Rf 14 14 14 Rf 14 14 14 14 14 Rf 14 29 14 14 14 14 14 1935 14 14 14 14 14 14 14 Vol 3299 294 294 3299 235 3299 3299 3299 244 3299 3299 3299 3299 3299 138 3299 275 3299 3299 3299 3299 3299 37 3299 3299 3299 3299 3299 3299 3299 Page 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 M 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1? 1 1 1 6 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 945 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions spodumene, green 共Maharitra, Madagascar兲 LiAlSi2 O⫹ 6 spodumene, colorless LiAlSi2 O*⫹ 6 amorphous spodumene 共Corning ESI glass兲 * petalite 共Karabib, SW Africa兲 Li0.90Na.10Al1.0Si4 O10 CaSiO*3 pseudowollastonite 共synthetic兲 BaSiO*3 共synthetic兲 BaSi2 O*5 sanbornite 共synthetic兲 Ca.46Mg.35Fe.15Mn.01Al.09Si.93O*⫹ 3 pigeonite Ca1.47Mn1.44Mg.09Si3 O*⫹ 9 bustamite 共Langban兲 Mn.8Ca.2SiO*⫹ 3 rhodonite 共Broken Hill兲 Mn.65Fe.13Ca.19Mg.03SiO*⫹ 3 rhodonite 共Morocco兲 Mn.80Ca.14Mg.05Fe.01SiO*⫹ 3 rhodonite 共Harstigen兲 (2⫹) Si2 O*⫹ CaMg.94Fe.06 6 diopside, colorless 共Nordmarken兲 (2⫹) Al.01Si1.99O*⫹ Ca.99Mn.01Mg.92Fe.08 6 diopside, yellow-green 共Nordmarken兲 CaMgSi2 O⫹ 6 diopside, colorless 共Zillertal兲 Ca.97Na.02Mg.93Fe.03Cr.02Al.01Si2 O*⫹ 6 diopside 共Russia兲 (2⫹) (2⫹) (3⫹) Ca.96Mn.01Fe.03 Mg.42Fe.56 Fe.02 Si2 O*⫹ 6 diopside, black 共Nordmarken兲 (2⫹) *⫹ CaMg.92Fe.08 Si2 O6 diopside 共Ala Valley兲 CaMgSi2 O*6 amorphous 共Corning兲 Ca2 MgSi2 O*⫹ 7 akermanite Ca2 MgSi2 O⫹ 7 akermanite Ca2 ZnSi2 O⫹ 7 hardystonite Ca2 ZnSi2 O*⫹ 7 hardystonite 共synthetic-Liebertz兲 Ca2 Al2 SiO*7 gehlenite 共synthetic兲 Ca2 Ga2 SiO*⫹ 7 Ca2 CoSi2 O*⫹ 7 Sr2 CoSi2 O*⫹ 7 (3⫹) Al.05Ti.03 Na.87K.02Ca.02Mn.02Fe.92 * aegirine 共Quincy, MA兲 Fe.03Si2 O5.95共OH兲.05 (3⫹) (2⫹) Fe.09 Na.70Ca.18Mg.12Fe.78 * Al.04Ti.02Si2 O5.95共OH兲.05 aegirine 共Laven, Norway兲 (3⫹) ⫹ Fe(2) .16 Ca.90Mn.01Na.06K.01Mg.63Fe.11 * Ti.12Al.29Si1.71O6 titanaugite 共Stoffel, Westerwald兲 (3⫹) (3⫹) Fe.10 Ti.10 Ca.87Mn.01Na.05K.03Mg.69Fe.16 * Al.24Si1.78O6 titanaugite 共Stoffel, Westerwald兲 (3⫹) *⫹ Mg.8Al17.2Fe(3⫹) Ti.1Si7.7O44共OH兲 3.2 Fe3.0 .3 staurolite 共St. Gotthard兲 ⫹ ’’ narsarsukite 关comp. not certain兴 ‘‘Na2 TiSi4 O11 (3⫹) Si2 O*6 Li.95Na.05Al0.95Fe.05 Chemical composition, sample designations 1.6510 1.5052 1.502 1.594 1.654 1.602 1.6843 1.6658 1.7125 1.7021 1.7030 1.6618 1.6647 1.6621 1.6621 1.6898 1.6620 1.5968 1.6152 1.6214 1.6530 1.6542 1.646 1.6998 1.5731 1.6174 1.758 1.729 1.703 1.682 1.7267 1.5351 1.497 1.594 1.654 1.587 1.6780 1.6528 1.7081 1.6980 1.6991 1.6549 1.6573 1.6527 1.6552 1.6829 1.6552 1.5968 1.6152 1.6214 1.6530 1.6542 1.646 1.6998 1.5731 1.6174 1.731 1.706 1.689 1.680 1.7218 1.5351 1.6580 ny 1.6454 1.5052 1.6541 nx 1.5702 1.7316 1.700 1.712 1.740 1.6828 1.5968 1.6237 1.6261 1.6431 1.6440 1.639 1.6909 1.6490 1.6510 1.769 1.7101 1.6839 1.6831 1.6877 1.508 1.631 1.656 1.601 1.7017 1.6671 1.7200 1.7101 1.7107 1.6821 1.6597 1.5052 1.6666 nz 1.5534 1.7392 1.700 1.719 1.743 1.6705 1.6125 1.6326 1.6391 1.6723 1.6735 1.665 1.7251 1.6197 1.6487 1.768 1.6991 1.6726 1.6715 1.6734 1.507 1.610 1.673 1.597 1.6981 1.6730 1.7296 1.7188 1.7219 1.6712 1.6602 1.5176 1.6684 nDx 1.5534 1.7449 1.707 1.723 1.768 1.6775 1.6125 1.6326 1.6391 1.6723 1.6735 1.665 1.7251 1.6197 1.6487 1.806 1.7063 1.6795 1.6785 1.6804 1.512 1.610 1.674 1.612 1.7043 1.6860 1.7344 1.7231 1.7262 1.6781 1.6649 1.5176 1.6713 nDy 1.5835 1.7508 1.728 1.742 1.782 1.6995 1.6125 1.6407 1.6431 1.6610 1.6618 1.657 1.7135 1.6764 1.6766 1.823 1.7281 1.7024 1.7001 1.7026 1.518 1.653 1.678 1.621 1.7228 1.6879 1.7424 1.7315 1.7338 1.7003 1.6756 1.5176 1.6809 nDz 228.64 369.95 111.28 111.28 107.75 109.90 125.95 153.63 153.63 153.55 153.55 149.09 155.83 154.60 166.50 107.28 110.94 109.90 109.94 109.90 211.21 66.41 79.87 120.52 54.13 184.04 58.38 58.38 58.38 109.83 97.31 129.37 97.31 Vm 20.78 15.41 18.55 18.55 17.96 18.32 20.99 21.95 21.95 21.94 21.94 21.30 22.26 22.08 23.78 17.99 18.49 18.32 18.32 18.32 21.12 22.14 26.62 24.10 18.04 20.45 19.46 19.46 19.46 18.30 16.22 21.56 16.22 Vo 17.305 35.131 10.124 10.283 10.214 9.762 10.242 12.850 12.933 13.366 13.384 12.882 14.328 12.599 14.117 10.462 10.172 9.758 9.768 9.800 14.889 5.470 6.994 9.799 4.928 16.256 5.467 5.407 5.412 9.752 8.494 9.164 8.572 具 ␣ e典 0.0090 0.0054 0.0080 0.0086 0.0114 0.0057 0.0071 0.0072 0.0072 0.0071 0.0070 0.0069 0.0078 0.0178 0.0117 0.0122 0.0055 0.0066 0.0059 0.0055 0.0067 0.0078 0.0074 0.0060 0.0068 0.0073 0.0067 0.0067 0.0073 0.0060 0.0056 0.0079 0.0051 具A典 0.7189 0.5047 0.5415 0.5281 0.5064 0.5628 0.6453 0.6181 0.6120 0.5809 0.5797 0.5872 0.5321 0.6460 0.6057 0.4826 0.5348 0.5632 0.5626 0.5594 0.7961 0.6334 0.5754 0.6454 0.5408 0.5676 0.5165 0.5259 0.5251 0.5631 0.5784 0.7901 0.5701 具B典 11.28 12.19 10.43 9.94 8.44 12.59 12.07 11.71 11.70 11.45 11.49 11.64 10.41 7.62 9.10 7.97 12.42 11.65 12.34 12.74 13.83 11.38 11.16 13.11 11.31 11.12 11.06 11.23 10.75 12.20 12.88 12.66 13.35 具 Eo典 15.6 24.1 19.2 18.8 16.6 22.3 18.7 18.9 19.1 19.7 19.8 19.8 19.5 11.8 15.0 16.5 23.2 20.6 21.9 22.7 17.3 17.96 19.39 20.3 20.90 19.5 21.42 21.35 20.47 21.6 22.27 16.0 23.42 具 Ed典 62 23 34 34 27 62 97 97 62 62 97 93 96 97 97 27 97 62 97 97 46 22 22 22 62 31 56 56 31 97 62 97 13 Year 1 ZEKRDZ ZEKRDZ ZEKRDZ AMMIAY Ref. JOBPDE JOBPDE Ref. Ref. JOBPDE JOAOD6 JOBPDE JOBPDE JOBPDE AMMIAY Ref. 1 1 1 1 1 Ref.10A Ref. JOBPDE Ref.10A AMMIAY AJSCAP AJSCAP AJSCAP Ref. 1 AMMIAY HAMBA6 HAMBA6 AMMIAY Ref.10A Ref. JOBPDE ZEKRDZ Coden Rf 57 87 87 12 Rf 14 14 Rf Rf 14 10 13 14 14 12 Rf 14 31 4 4 4 Rf 16 1 1 16 Rf 14 13 Vol 365 310 1 1 233 1767 3299 3299 414 414 3299 2246 1941 3299 3299 233 1027 1697 3299 1027 51 331 331 331 2173 488 137 137 488 1027 2966 3299 294 Page M 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 2 1 5 1 1 2 2 2 2 1 1 1 1 1 1 1 1 1 E 1 2 3 3 3 2 1 1 1 1 1 3 2 1? 1 3 1 1 1 1 3 3 3 3 1 1 1 1 2 1 2 1 2? TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O- atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 946 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions 1.5136 1.5115 1.5082 1.5130 1.5063 1.5091 1.527 1.527 1.5092 1.5076 1.524 1.524 1.5097 1.5147 1.526 1.526 1.5060 1.5103 1.7099 1.7099 1.5117 1.5203 1.5208 1.4741 1.4710 1.4705 1.4703 1.7020 1.4741 1.4710 1.4705 1.4703 1.7020 1.5117 1.5167 1.5168 1.8619 1.8457 1.4970 1.8356 1.8752 1.8801 1.8232 1.8595 1.8698 1.4970 1.8508 1.8404 1.528 1.8693 1.8327 1.8785 1.8513 1.8124 1.8731 1.528 1.6461 1.6277 leucosphenite 共Narsarsuk, Greenland?兲 CaTiSiO5 :Fe⫹ titanite1 共Pfitschtal兲 CaTiSiO5 :Al,Fe⫹ titanite2 共Muttenhoernern兲 Ca1.0Ti1.0SiO*⫹ 5 titanite, light green 共Eisbruckalp, Pfunders, Tirol兲 Ca1.0Ti1.0SiO*⫹ 5 titanite, light brown 共Glimmerschiefer, St.Gotthard兲 Ca1.0Ti.98Mn.02SiO*⫹ 5 titanite 共Val Maggia, Tessin兲 Ca1.0Ti0.96Fe.04SiO*⫹ 5 titanite 共unknown source兲 Ca0.85Ti1.02Si1.04O⫹ 5 titanite 共Schwarzenstein, Zillertal兲 Ca0.75Ti1.05Si1.07O⫹ 5 titanite 共Wildkreuzjoch, Pfitsch, Tirol兲 Na4 Al3 Si3 O12Cl*⫹ sodalite 共Tiahuanaco兲 Na4 Al3 Si3 O12Cl*⫹ sodalite 共Tiahuanaco兲 ‘‘Na4 Al3 Si3 O12Cl’’⫹ sodalite 共Vesuvius兲 ‘‘Na4 Al3 Si3 O12Cl’’⫹ sodalite 共Vesuvius兲 *⫹ Ca19Mg.1AlFeMg1.7Fe.6Si18O69共OH兲10 vesuvianite 共Ala Valley兲 *⫹ Ca18.1Mg.1Al4 FeAl5.2Mg1.6Fe • 0.5Ti0.8Si18O69共OH兲10 vesuvianite 共Val D’Aosta兲 Na.69K.16Ca.06Al.98Si1.02O*4 nepheline 共Monte Somma, Mt. Vesuvius, xtal #2兲 Na.69K.16Ca.06Al.98Si1.02O*4 nepheline 共Monte Somma, Mt. Vesuvius, xtal #1兲 Na.68K.17Ca.04Al.93Si1.06O*4 nepheline 共Larvik, #VII兲 Norway Na.55K.23Ca.06Al.82Si1.16O*4 nepheline 共Monte Somma, #VII兲 Mt. Vesuvius KAlSi2 O⫹ 6 leucite, cubic but with tetragonal cell 共Rome兲 CsAlSi2 O6 . x H2 O⫹ pollucite Na.97K.02AlSi3 O*⫹ 8 albite 共Amelia兲 FL 1250 K Na.97K.02Ca.01Al.97Fe.01Mg.02Si3 O*⫹ 8 albite 共Rischuna兲 FL 1250 K K.90Na.10AlSi3 O*⫹ 8 adularia 共St. Gotthard兲 K.73Na.24Ca.03Al1.03Si2.97O*⫹ 8 orthoclase, moonstone 共Ceylon兲 KAlSi3 O⫹ 8 orthoclase 共Madagascar兲 K.92Na.08Al.97Fe.03Si3 O*⫹ 8 orthoclase 共Madagascar兲 KAlSi3 O8 ⫹ microcline, green amazonite K.85Na.15AlSi3 O*⫹ 8 sanidine 共Eifel兲 ⫹ ’’ ‘‘BaNa4 Ti2 B2 Si10O30 ny nx Chemical composition, sample designations 1.5102 1.5133 1.5136 1.5122 1.5120 1.5168 1.5117 1.5265 1.5267 1.4970 1.525 1.524 1.521 1.522 1.7051 1.4741 1.4710 1.4705 1.4703 1.6992 1.8739 1.9233 2.0199 2.0028 1.9570 2.0049 1.9240 1.9345 1.6671 nz 1.5184 1.5208 1.5214 1.5193 1.5163 1.5224 1.5246 1.5285 1.5291 1.5087 1.541 1.540 1.537 1.538 1.7314 1.4831 1.4826 1.4839 1.4825 1.7224 1.9032 1.8876 1.9097 1.9159 1.8879 1.9004 1.8713 1.9057 1.6441 nDx 1.5221 1.5253 1.5258 1.5237 1.5199 1.5269 1.5246 1.5324 1.5330 1.5087 1.541 1.540 1.537 1.538 1.7314 1.4831 1.4826 1.4839 1.4825 1.7224 1.9057 1.8942 1.9178 1.9216 1.8941 1.9117 1.8761 1.9090 1.6607 nDy 1.5247 1.5254 1.5261 1.5242 1.5216 1.5289 1.5246 1.5386 1.5388 1.5087 1.537 1.536 1.534 1.535 1.7275 1.4831 1.4826 1.4839 1.4825 1.7209 1.9174 1.9796 2.1145 2.0529 2.0087 2.0959 1.9941 1.9913 1.6877 nDz 179.68 180.82 180.10 180.10 179.60 180.10 159.80 166.00 166.15 146.59 91.00 90.90 90.79 90.79 1432.70 349.92 349.92 349.92 349.92 1431.09 92.22 92.22 92.60 92.22 92.22 92.22 92.22 92.22 593.15 Vm 22.46 22.60 22.51 22.51 22.46 22.51 26.63 20.75 20.77 24.43 22.75 22.72 22.70 22.70 18.13 26.91 26.91 26.91 26.91 18.11 18.44 18.44 18.52 18.44 18.44 18.44 18.44 18.44 19.77 Vo 12.792 12.949 12.905 12.868 12.807 12.943 11.442 12.070 12.087 10.241 6.679 6.661 6.621 6.639 133.403 23.481 23.350 23.328 23.320 132.203 9.922 9.924 10.430 10.382 10.104 10.310 9.888 10.206 51.458 具 ␣ e典 0.0085 0.0075 0.0076 0.0074 0.0063 0.0075 0.0079 0.0072 0.0073 0.0077 0.0072 0.0072 0.0075 0.0075 0.0068 0.0065 0.0085 0.0098 0.0089 0.0067 0.0097 0.0120 0.0104 0.0081 0.0091 0.0104 0.0115 0.0073 0.0065 具A典 0.7844 0.7779 0.7773 0.7804 0.7826 0.7740 0.7780 0.7611 0.7607 0.8058 0.7505 0.7524 0.7576 0.7552 0.5213 0.8524 0.8592 0.8603 0.8606 0.5281 0.4064 0.4076 0.3765 0.3757 0.3949 0.3813 0.4106 0.3863 0.5844 具B典 12.17 12.92 12.79 12.96 14.07 12.88 12.52 13.04 12.93 12.95 12.88 12.91 12.69 12.66 11.06 14.46 12.69 11.82 12.41 11.25 8.17 7.37 7.60 8.59 8.32 7.66 7.56 9.18 11.99 具 Eo典 15.5 16.6 16.4 16.6 17.9 16.6 16.0 17.1 17.0 16.0 17.17 17.16 16.76 16.76 21 16.9 14.7 13.7 14.4 21 20.10 18.08 20.18 22.87 21.08 20.10 18.42 23.76 20.5 具 Ed典 62 16 16 97 21 16 62 24 24 62 31 31 31 31 97 62 62 97 97 97 97 97 97 97 97 56 56 97 38 Year Ref. 1 MNLMBB MNLMBB JOBPDE TTMMDZ MNLMBB Ref. 1 ZEKRDZ ZEKRDZ Ref. 1 MNLMBB MNLMBB MNLMBB MNLMBB JOBPDE Ref. 1 Ref. 1 Ref. 10A Ref. 10A JOBPDE Ref. 10A Ref. 10A JOBPDE Ref. 10A Ref. 10A HAMBA6 HAMBA6 Ref. 10A Ref. 10C Coden Rf 17 17 14 35 17 Rf 61 61 Rf 22 22 22 22 14 14 Rf Rf 14 1 1 Vol 2966 237 253 3299 231 253 2748 226 226 2791 569 569 569 569 3299 2597 2597 885 885 3299 1609 1609 3299 1609 1609 285 285 1609 293 Page M 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 1 1 1 1 1 1 1 1 1 1 1 1 1 E 1? 1 1 1 1? 1 1 1 1 2 3 3 1 2? 2 2? 2 1 3 2 1 3? 2? 1 1 4? 2 TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 947 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions CaAl2 Si2 O8 anorthite 共Vesuvius兲 FL? CaAl2 Si2 O⫹ 8 anorthite 共hi-temp form兲 FL? CaAl2 Si2 O8 anorthite 共Mijakejima兲 FL? Ca0.96Na.05Al1.93Fe.02Si2.04O*⫹ 8 anorthite 共Great Sitka Island兲 FL? CaAl2 Si2 O*⫹ 8 amorphous 共Corning兲 Na.56Ca.36K.08Al1.40 Si2.60O*⫹ 8 andesine 共Maeyama, Shinano, Japan兲 Na.75Ca.24K.01Al1.25Si2.75O*⫹ 8 oligoclase 共Hawke Mine, Bakersville, NC兲 Ca.61Na.32K.05Al1.62 Fe.01Si2.37O*⫹ 8 labradorite 共County Down, Ireland兲 Ba.98K.02Al1.98Si2.02O8 celsian 共1920兲 关anomalous dispersion兴 Ba.93K.04Na.02Mg.01 Al1.98Fe.02Si2 O*⫹ 8 paracelsian 共Benallt mine, Rhiw, Carnarvonshire兲 Ca3 Si2 O6 共OH兲2 共OH2 兲*⫹ 2 afwillite 共Dutoitspan-Mine, Kimberley兲 used 3 n’s Ca3 Si2 O6 共OH兲2 共OH2 兲*⫹ 2 afwillite 共Dutoitspan-Mine, Kimberly兲 used only 2 n’s Ca2 Al3 Si3 O12OH⫹ clinozoisite 共Schwarzensteinalpe, Zillertal兲 Ca1.99Sr.01Al2.99Mg.01V.01Si3 O12OH*⫹ zoisite1 共Merelani Hill, Arusha, Tanzania兲 Ca2.00Al3.00V.02Si2.98O12OH*⫹ zoisite2 共Merelani Hills, Arusha, Tanzania兲 Ca1.90Mg.04Fe.06Al2.4Fe.6Si3 O12OH*⫹ epidote 共Pfarreb, Zoptau兲 Ca2 Al2 FeSi3 O12OH*⫹ epidote 共pistazite, Rauhbeerstein, Zoptau兲 Ca1.94Fe.06Al2.1Fe.9Si3 O12OH*⫹ epidote 共Knappenwand, Sulzbachtal兲 Ca2.00Al2.46Fe.52Si3 O12OH*⫹ epidote 共Pakistan兲 Na2.67K.28Ca1.06Sr.01Al3.79Si8.19Fe.02Cl.76 *⫹ 共CO3 兲.19共SO4 兲.08 O24 scapolite ⫹ scapolite 具共Na,K兲3 Ca典关Al4 Si8 兴共Cl,CO3 兲O24 scapolite⫹ scapolite⫹ scapolite⫹ scapolite⫹ 共Lago Tremorgio兲 Ca共UO2 兲共UOOH兲共SiO4 兲共SiO3 OH兲•4 H2O* beta-uranophane 共Mitchell County, NC兲 Chemical composition, sample designations 1.5666 1.5680 1.5679 1.5689 1.5609 1.5357 1.5317 1.5523 1.6168 1.5666 1.6067 1.6093 1.6990 1.6772 1.6775 1.7184 1.7438 1.7293 1.6969 1.5431 1.5694 1.5713 1.5754 1.5556 1.5714 1.676 1.5609 1.5315 1.5275 1.5477 1.6133 1.5472 1.6043 1.6076 1.6958 1.6752 1.6754 1.7022 1.7053 1.6957 1.6950 1.5431 1.5694 1.5713 1.5754 1.5556 1.5714 1.654 ny 1.5613 1.5591 1.5589 1.5600 nx 1.5391 1.5419 1.5457 1.5354 1.5412 1.676 1.6993 1.5318 1.7479 1.7617 1.7230 1.6846 1.6839 1.6997 1.6230 1.6206 1.5743 1.6227 1.5568 1.5354 1.5609 1.5393 1.5740 1.5714 1.5737 1.5729 nz 1.5833 1.5858 1.5904 1.5696 1.5850 1.663 1.7147 1.5569 1.7266 1.7287 1.7215 1.6914 1.6913 1.7139 1.6169 1.6175 1.5691 1.5885 1.5620 1.5403 1.5751 1.5449 1.5743 1.5737 1.5738 1.5743 nDx 1.5833 1.5858 1.5904 1.5696 1.5850 1.687 1.7191 1.5569 1.7573 1.7632 1.7423 1.6937 1.6933 1.7175 1.6204 1.6209 1.5829 1.5927 1.5661 1.5447 1.5751 1.5489 1.5824 1.5820 1.5818 1.5829 nDy 1.5516 1.5549 1.5590 1.5485 1.5531 1.697 1.7236 1.5449 1.7742 1.7794 1.7501 1.7010 1.7006 1.7191 1.6336 1.6340 1.5872 1.5984 1.5711 1.5480 1.5751 1.5528 1.5877 1.5871 1.5871 1.5876 nDz 353.37 227.84 552.19 227.80 227.80 227.80 225.40 225.80 225.80 214.83 214.83 186.52 183.95 167.00 166.40 172.05 166.90 167.51 167.51 167.51 167.51 Vm 22.08 17.52 22.09 17.52 17.52 17.52 17.34 17.37 17.37 21.48 21.48 23.31 22.99 20.87 20.80 21.50 20.86 20.94 22.51 22.51 20.94 Vo 31.464 20.955 41.318 21.578 21.863 21.354 20.316 20.342 20.793 17.859 17.794 14.455 15.378 12.744 12.301 13.299 12.414 13.069 13.048 13.061 13.069 具 ␣ e典 0.0069 0.0072 0.0072 0.0073 0.0067 0.0050 0.0071 0.0076 0.0084 0.0059 0.0071 0.0056 0.0056 0.0060 0.0044 0.0059 0.6991 0.6958 0.6898 0.7151 0.6960 0.5608 0.5319 0.7303 0.5074 0.4965 0.5157 0.5496 0.5500 0.5309 0.6240 0.6275 0.6938 0.6186 ⫺0.0109 0.0087 0.7095 0.7433 0.6962 0.7365 0.6866 0.6884 0.6874 0.6867 具B典 0.0075 0.0074 0.0073 0.0075 0.0071 0.0074 0.0070 0.0072 具A典 12.72 12.47 12.34 12.51 12.93 13.44 10.94 12.42 9.81 11.62 10.74 12.58 12.53 11.86 15.01 13.08 11.32 9.51 12.32 12.71 12.35 12.50 12.45 12.19 12.49 12.38 具 Eo典 18.20 17.92 17.89 17.49 18.58 23.9 20.5 17.0 19.3 23.4 20.8 22.8 22.7 22.3 24.0 20.8 16.3 15. 17.3 17.1 17.7 16.9 18.1 17.7 18.1 18.0 具 Ed典 62 62 62 62 62 39 97 97 62 62 62 97 97 17 25 25 42 65 23 23 97 23 62 62 78 97 Year Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 AMMIAY JOBPDE JOBPDE Ref. 1 Ref. 1 Ref. 1 JOBPDE JOBPDE TTMMDZ MNLMBB MNLMBB MNLMBB MNLMBB MNLMBB MNLMBB JOBPDE MNLMBB Ref. 1 Ref. 1 AMMIAY JOBPDE Coden Rf Rf Rf Rf Rf 24 14 14 Rf Rf Rf 14 14 34 20 20 26 35 20 20 14 20 Rf Rf 63 14 Vol 2852 2852 320 496 417 324 3299 3299 2983 2983 2983 3299 3299 23 277 277 231 508 93 93 3299 93 1751 4151 394 3299 Page 1 1 1 1 1 2 1 1 1 1 1 1 1 1 5 5 1 2 1 1 1 1 1 1 2 1 M 1 1 1 1 2 3? 1 1 1 1? 1 1 1 1 2? 2 2? 1 1 1 1 1 1 1 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 948 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions * Ca共UO2 兲共UOOH兲共SiO4 兲共SiO3 OH兲•4 H2O beta-uranophane 共Jachymov, Joachimstal兲 Germanates * Na4 Ge9 O20 *⫹ K2 Ge4 O9 共synthetic-H. Weber兲 *⫹ 共synthetic-H. Weber兲 FL? K2 Ge8 O17 *⫹ Bi4 Ge3 O12 *⫹ Bi4 Ge3 O12 * Bi4 Ge3 O12 *⫹ Bi4 Ge3 O12 *⫹ Ca3 Ga2 Ge3 O12 *⫹ CaY2 Mg2 Ge3 O12 *⫹ Ca.90Y1.88Mg2.27Ge3 O12 *⫹ CaY1.92Nd.08Zn2 Ge3 O12 *⫹ Nd2.95Mg1.48In.68Ga1.54Ge1.32O12 *⫹ Ca3 Ga2 Ge4 O14 *⫹ Sr3 Ga2 Ge4 O14 Ba1.92Nd.04Ce.04MgGe2 O*⫹ 7 Ba1.99Nd.01ZnGe2 O*7 *⫹ Pb5 Ge3 O11 FE 450 K *⫹ FE 450 K Pb5 Ge3 O11 Tellurites Bi2 TeO*⫹ 5 Titanates Li2 Ti3 O*⫹ 7 CaTiO3 CaTiO⫹ 3 SrTiO*⫹ 3 FE FL 100 K SrTiO*⫹ 3 FE FL 100 K SrTiO*⫹ 3 FE FL 100 K SrTiO*⫹ 3 FE FL 100 K *⫹ FE FL SrTiO2.929 * SrTiO3 FE FL 100 K BaTiO*⫹ 3 FE 403 K FL 393 K BaTiO*⫹ 3 FE 403 K FL 393 K Ba.77Ca.23TiO*⫹ 3 FE FL PbTiO*⫹ 3 FE 763 K PbTiO*⫹ 3 FE 763 K PbTiO*3 ceramic Pb.88La.08Zr.80Ti.20O*3 ceramic Pb.85La.10Zr.65Ti.35O*3 ceramic Pb.97La.02Zr.65Ti.35O*3 ceramic Pb.76La.16Ti.60Zr.40O*3 ceramic Pb.64La.24Ti.90Zr.10O*3 ceramic Chemical composition, sample designations 1.658 1.665 1.7026 1.6679 2.0267 2.0218 2.022 2.0338 1.8186 1.8137 1.8065 1.8646 1.9039 1.7701 1.7690 1.6833 1.732 2.0332 2.0275 2.2520 2.2204 1.5554 2.261 2.2675 2.2629 2.2647 2.2485 2.2950 2.268 2.2943 2.2957 2.2726 2.5617 2.5218 2.523 2.363 2.374 2.395 2.421 2.478 1.665 1.7026 1.6666 2.0267 2.0218 2.022 2.0338 1.8186 1.8137 1.8065 1.8646 1.9039 1.7701 1.7690 1.6833 1.732 2.0332 2.0275 2.2075 2.0496 1.5554 2.261 2.2675 2.2629 2.2647 2.2485 2.2950 2.268 2.2943 2.2957 2.2726 2.5617 2.5218 2.523 2.363 2.374 2.395 2.421 2.478 ny 1.653 nx 2.2883 1.3304 2.261 2.2675 2.2629 2.2647 2.2485 2.2950 2.268 2.2605 2.2613 2.2449 2.5617 2.5226 2.523 2.363 2.374 2.395 2.421 2.478 2.2760 1.675 1.7326 1.6757 2.0267 2.0218 2.022 2.0338 1.8186 1.8137 1.8065 1.8646 1.9039 1.7954 1.7876 1.7211 1.735 2.0661 2.0579 1.665 nz 2.1600 1.5849 2.407 2.4088 2.4145 2.4152 2.4053 2.4035 2.410 2.4408 2.4401 2.4197 2.7899 2.6955 2.693 2.498 2.509 2.543 2.575 2.656 2.3402 1.688 1.7273 1.6913 2.1077 2.1001 2.097 2.1083 1.8480 1.8410 1.8341 1.8975 1.9425 1.7996 1.7984 1.7089 1.752 2.1304 2.1262 1.661 nDx 2.3513 1.5849 2.407 2.4088 2.4145 2.4152 2.4053 2.4035 2.410 2.4408 2.4401 2.4197 2.7899 2.6955 2.693 2.498 2.509 2.543 2.575 2.656 2.3904 1.688 1.7273 1.6928 2.1077 2.1001 2.097 2.1083 1.8480 1.8410 1.8341 1.8975 1.9425 1.7996 1.7984 1.7089 1.752 2.1304 2.1262 1.681 nDy 2.4297 1.3358 2.407 2.4088 2.4145 2.4152 2.4053 2.4035 2.410 2.3833 2.3829 2.3708 2.7899 2.6848 2.693 2.498 2.509 2.543 2.575 2.656 2.4264 1.699 1.7591 1.7012 2.1077 2.1001 2.097 2.1083 1.8480 1.8410 1.8341 1.8975 1.9425 1.8239 1.8166 1.7477 1.764 2.1662 2.1606 1.689 nDz 141.19 56.03 56.03 59.20 59.20 59.20 59.20 59.33 59.20 64.60 64.60 63.30 63.14 63.14 63.14 69.73 68.22 68.67 65.89 63.09 131.85 417.82 198.19 395.50 291.60 291.60 291.60 291.60 229.89 233.00 233.01 237.50 253.10 280.00 299.28 194.43 193.48 325.12 325.12 353.37 Vm 20.17 18.68 18.68 19.70 19.70 19.70 19.70 20.25 19.70 21.50 21.50 21.10 21.05 21.05 21.05 23.24 22.74 22.89 21.96 21.03 26.37 20.88 22.02 23.26 24.30 24.30 24.30 24.30 19.16 19.42 19.42 19.79 21.09 20.00 21.38 27.77 27.64 29.47 29.47 22.08 Vo 18.790 3.803 7.734 8.196 8.179 8.185 8.124 8.317 8.198 9.007 9.012 8.747 9.792 9.665 9.668 10.062 9.888 10.036 9.727 9.511 18.065 37.188 18.540 35.273 35.420 35.308 35.313 35.581 23.860 24.077 23.921 25.641 28.197 28.006 29.839 17.859 18.494 39.930 39.767 31.093 具 ␣ e典 0.0122 0.0127 0.0120 0.0115 0.0124 0.0123 0.0131 0.0087 0.0116 0.0110 0.0109 0.0115 0.0112 0.0092 0.0092 0.0096 0.0093 0.0098 0.0098 0.0102 0.0119 0.0082 0.0078 0.0087 0.0109 0.0106 0.0103 0.0099 0.0067 0.0063 0.0065 0.0067 0.0071 0.0074 0.0075 0.0084 0.0066 0.0125 0.0129 0.0066 具A典 0.2676 0.9026 0.2430 0.2415 0.2427 0.2422 0.2466 0.2343 0.2414 0.2375 0.2371 0.2426 0.1798 0.1865 0.1864 0.2186 0.2156 0.2111 0.2058 0.1945 0.2477 0.5605 0.5176 0.5589 0.3218 0.3239 0.3237 0.3189 0.4334 0.4368 0.4418 0.4037 0.3810 0.4624 0.4649 0.5335 0.4990 0.3147 0.3173 0.5711 具B典 5.92 10.65 5.70 5.78 5.60 5.62 5.50 6.58 5.77 5.87 5.90 5.81 5.06 5.70 5.71 6.04 6.09 5.87 5.80 5.53 5.77 10.44 10.33 10.13 6.88 6.98 7.10 7.17 10.15 10.50 10.41 9.84 9.27 9.99 9.96 10.10 10.96 6.34 6.27 11.79 具 Eo典 22.1 11.80 23.44 23.96 23.07 23.21 22.29 28.09 23.92 24.71 24.90 23.93 28.14 30.55 30.61 27.61 28.24 27.79 28.18 28.41 23.2 18.6 19.9 18.1 21.3 21.5 21.9 22.4 23.4 24.0 23.5 24.3 24.3 21.6 21.4 18.9 21.9 20.1 19.7 20.6 具 Ed典 84 78 58 86 78 79 95 95 65 71 86 97 73 71 77 77 77 77 77 77 94 82 00 95 72 95 71 96 97 79 97 97 97 87 87 97 90 72 97 39 Year WLHPAR Ref. 7 JCPSA6 Ref. 4 Ref. 7 Ref. 2B SPHCA6 SPHCA6 JAPIAU Ref. 6 Ref. 4 PSSABA JJAPA5 Ref. 6 APOPAI APOPAI APOPAI APOPAI APOPAI APOPAI PAOAE1 MRBUAC Ref. 14 Ref. 12 JAPIAU OPSUA3 Ref. 6 APOPAI JOBPDE PRBMDO JOBPDE JOBPDE JOBPDE SPHCA6 SPHCA6 JOBPDE JOBPDE JAPIAU PSSABA AMMIAY Coden 16 16 16 16 16 16 159 12 Rf 40 40 36 28 33 3 1301 7-80 824 29 7-106 72b1 640 640 1674 509 24 559 531 513 3210 3210 3210 3210 3210 3210 839 5110 868 510 3562 3299 4343 3299 3299 3299 236 236 3299 1190 4907 559 43 79 35 14 20 14 14 14 32 32 14 7 43 159 1313 324 Page 17 24 Vol M 1 1 7 1 1 1 1 1 1 1 1 1 8 1 1 1 1 1 1 1 1 1 1 1 1 6 8 1 1 1 1 1 1 1 1 1 1 1 1 2 E 1 7 5 1 1 1 1 1? 3 1 1 2 1 2? 3? 3 3 3 3 3 1 3 1 2 1 2 3 1 1 1 1 1 1 1 1 1 3? 2 2 3? TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E O and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 949 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions K Phosphates AlPO*⫹ 4 berlinite 共synthetic兲 AlPO*⫹ 4 berlinite, 20 ppm H2 O 共synthetic兲 AlPO*⫹ 4 berlinite, 100 ppm H2 O 共synthetic兲 AlPO*⫹ 4 berlinite, 250 ppm H2 O 共synthetic兲 AlPO*⫹ 4 berlinite, 1000 ppm H2 O 共synthetic兲 AlP3 O*⫹ 9 GaPO*⫹ 4 ScPO*4 YPO*4 TbPO*4 DyPO*4 HoPO*4 ErPO*4 TmPO*4 YbPO*4 LuPO*4 LuPO*4 Pb3 P2 O⫹ 8 共Pb5 P3 O12F?兲 composition uncertain, FL 453 K Pb3 P2 O8 :2%CePO⫹ 4 共Pb5 P3 O12F?兲 composition uncertain, FL Pb5 P3 O12Cl*⫹ pyromorphite, green 共Ems, Naussau兲 Pb5 P3 O12Cl*⫹ pyromorphite, brown 共Holzappel, Nassau兲 *⫹ FL 419 K NdP5 O14 * FL 175 K GdP5 O14 *⫹ FL? ErP5 O14 NaBePO*⫹ 4 beryllonite 共Stoneham, ME兲 NaBePO*⫹ 4 beryllonite 共Stoneham, ME兲 KGeOPO*⫹ 4 KTiOPO*⫹ 4 probable FE 1207 K * KTiOPO4 probable FE 1207 K K.85Rb.15TiOPO*⫹ 4 RbTiOPO*⫹ 4 probable FE 1062 K Li.95Ca.03Mg.02Fe.59Mn.41PO*4 triphylite 共Grafton, NH兲 *⫹ fluorapatite Ca4.91Na.08Y.04共PO4 兲2.95共SiO4 兲.03共SO4 兲.02F1.90Cl.12 *⫹ Ca4.95Mn.03Fe.02共PO4 兲2.96F1.02 fluorapatite 共unknown source兲 Ca5 共PO4 兲3 共OH.6F.4兲⫹ fluorapatite 共Zillertal, Tirol兲 *⫹ fluorapatite 共Rotenkopf兲 Ca4.98Fe.02共PO4 兲3 F.99Cl.01 Ca4.98Fe.02共PO4 兲3 F*⫹ fluorapatite 共Knappenwand兲 *⫹ montebrasite Li.97Na.03AlPO4 共OH兲.88F.12 Li1.93Na.04K.01Mg.02Al2 P2 O8 共F.9OH1.1兲*⫹ montebrasite 共Karibib, SW Africa兲 *⫹ montebrasite 共Minas Gerais兲 Li1.0Al1.0P1.0O4 共OH兲.98F.02 *⫹ KH2 PO4 FE 123 K FL 220 K Pb.88La.08Ti.90Zr.10O*3 ceramic Ba2 TiSi2 O*⫹ 8 fresnoite FE ⬎670 Chemical composition, sample designations 1.5140 1.5136 1.5136 1.5137 1.5136 1.5488 1.5862 1.696 1.636 1.657 1.663 1.660 1.660 1.660 1.661 1.659 1.68 1.9144 1.9157 1.9929 1.9944 1.5972 1.5883 1.6022 1.5459 1.5477 1.6472 1.7313 1.729 1.7337 1.7567 1.670 1.6218 1.6198 1.6313 1.6318 1.6253 1.6096 1.598 1.6160 1.4972 1.6083 1.4972 2.500 1.7379 ny 1.5140 1.5136 1.5136 1.5137 1.5136 1.5488 1.5862 1.696 1.636 1.657 1.663 1.660 1.660 1.660 1.661 1.659 1.68 1.9144 1.9157 1.9929 1.9944 1.5922 1.6135 1.6080 1.5404 1.5410 1.6420 1.7252 1.732 1.7304 1.7508 1.670 1.6218 1.6198 1.6313 1.6318 1.6253 1.6000 1.584 2.500 1.7379 nx 1.6347 1.4587 1.5226 1.5223 1.5224 1.5224 1.5223 1.5488 1.6036 1.894 1.810 1.842 1.844 1.843 1.837 1.832 1.837 1.834 1.74 1.8873 1.8832 1.9835 1.9841 1.6132 1.5778 1.5880 1.5531 1.5509 1.6553 1.8091 1.809 1.8117 1.8300 1.678 1.6186 1.6175 1.6275 1.6283 1.6227 1.6259 1.606 2.500 1.7390 nz 1.6290 1.4682 1.9701 1.9696 2.0585 2.0587 1.6067 1.6159 1.6076 1.5578 1.5590 1.6636 1.7780 1.777 1.7794 1.8057 1.688 1.6363 1.6348 1.6461 1.6462 1.6391 1.6219 1.608 1.9701 1.9696 2.0585 2.0587 1.6116 1.6298 1.6128 1.5519 1.5523 1.6585 1.7683 1.771 1.7722 1.7943 1.687 1.6363 1.6348 1.6461 1.6462 1.6391 1.6121 1.594 1.6211 1.4682 1.5244 1.5247 1.5244 1.5247 1.5246 1.5606 1.6008 1.718 1.652 1.677 1.682 1.678 1.676 1.678 1.676 1.675 2.669 1.7641 nDy 1.5244 1.5247 1.5244 1.5247 1.5246 1.5606 1.6008 1.718 1.652 1.677 1.682 1.678 1.676 1.678 1.676 1.675 2.669 1.7641 nDx 1.6480 1.5092 1.9363 1.9323 2.0477 2.0476 1.6285 1.6097 1.5954 1.5620 1.5624 1.6732 1.8724 1.874 1.8765 1.8947 1.694 1.6328 1.6323 1.6417 1.6417 1.6360 1.6387 1.616 1.5335 1.5339 1.5336 1.5338 1.5337 1.5606 1.6189 1.922 1.831 1.866 1.861 1.861 1.852 1.849 1.853 1.855 2.669 1.7617 nDz 80.54 96.85 77.34 77.34 77.34 77.34 77.34 161.73 76.65 62.57 71.25 73.07 72.10 71.35 70.65 70.00 69.30 68.67 68.67 301.10 301.10 316.58 316.58 256.90 250.81 248.54 75.10 75.11 99.45 108.89 108.89 108.99 111.26 73.24 262.65 261.57 262.00 262.00 262.00 80.54 80.54 63.59 189.00 Vm 16.11 24.21 19.34 19.34 19.34 19.34 19.34 17.97 19.16 15.64 17.81 18.27 18.02 17.84 17.66 17.50 17.32 17.17 17.17 23.16 23.16 24.35 24.35 18.35 17.91 17.75 18.77 18.78 19.89 21.78 21.78 21.80 22.25 18.31 20.53 20.32 20.15 20.15 20.15 16.11 16.11 21.20 23.62 Vo 6.751 6.619 5.585 5.581 5.582 5.582 5.581 12.278 6.192 6.159 6.531 6.880 6.822 6.735 6.655 6.582 6.532 6.457 6.336 33.582 33.569 37.530 37.561 21.006 20.296 20.282 5.681 5.682 8.640 10.646 10.662 10.692 11.135 6.552 22.046 21.908 22.255 22.272 22.097 6.682 6.542 9.661 18.164 具 ␣ e典 0.0054 0.0076 0.0096 0.0094 0.0096 0.0094 0.0065 0.0114 0.0027 0.0059 0.0062 0.0064 0.0133 0.0130 0.0131 0.0128 0.0059 0.0060 0.0062 0.0059 0.0057 0.0056 0.0053 0.0047 0.0064 0.0068 0.0067 0.0068 0.0068 0.0063 0.0068 0.0063 0.0059 0.0064 0.0057 0.0056 0.0048 0.0055 0.0048 0.0054 0.0094 0.0071 具A典 0.6162 0.8596 0.3803 0.3806 0.3379 0.3374 0.6400 0.6506 0.6420 0.7187 0.7185 0.5826 0.4822 0.4806 0.4794 0.4631 0.5560 0.6147 0.6169 0.6035 0.6028 0.6102 0.6260 0.6469 0.7687 0.7694 0.7694 0.7693 0.7694 0.7149 0.6518 0.4839 0.5441 0.5208 0.5163 0.5185 0.5197 0.5211 0.5194 0.5214 0.1905 0.4947 具B典 13.47 13.46 7.96 8.04 7.51 7.57 12.53 9.53 19.62 13.99 13.66 12.07 7.62 7.69 7.66 7.62 12.27 12.81 12.57 12.81 13.06 13.22 13.73 14.83 13.83 13.41 13.56 13.44 13.49 13.42 12.41 11.04 12.12 11.39 12.02 12.20 13.19 12.26 13.12 12.39 5.69 10.53 具 Eo典 21.85 15.65 20.9 21.1 22.2 22.4 19.5 14.6 30.5 19.46 19.01 20.72 15.8 16.0 15.9 16.4 22.07 20.8 20.3 21.2 21.6 21.6 21.93 22.92 18.00 17.42 17.62 17.48 17.53 18.7 19.04 22.82 22.27 21.87 23.29 23.53 25.37 23.54 25.26 23.76 29.86 21.2 具 Ed典 97 69 65 97 97 97 97 97 97 00 00 00 00 00 00 00 00 00 76 23 23 31 31 97 87 87 62 97 94 91 94 94 93 33 97 97 62 08 08 54 46 77 77 Year JOBPDE Ref. 2A JAPIAU JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE JOBPDE OMATET OMATET OMATET OMATET OMATET OMATET OMATET OMATET OMATET JPCSAW ZEKRDZ ZEKRDZ ZEKRDZ ZEKRDZ JOBPDE WLHPAR WLHPAR Ref. 1 JOBPDE CRTEDF Ref. 8 CRTEDF CRTEDF PSISDG Ref. 10B JOBPDE JOBPDE Ref. 1 ZEKRDZ ZEKRDZ NJGMA2 AMMIAY APOPAI JCRGAE Coden 14 Rf 14 14 Rf 45 45 1954 31 29 29 1863 36 14 14 14 14 14 14 15 15 15 15 15 15 15 15 15 37 58 58 77 77 14 36 36 Rf 14 29 16 40 Vol 3299 93 1674 3299 3299 3299 3299 3299 3299 103 103 103 103 103 103 103 103 103 321 226 226 437 437 3299 823 823 2556 3299 583 103 583 583 43 227 3299 3299 2850 555 555 257 51 3210 200 Page 1 1 1 1 1 1 1 1 1 4 4 4 4 4 4 4 4 4 7 1 1 1 1 1 8 8 1 1 1 8 1 1 5 8 1 1 1 1 1 1 2 1 1 M 3 1 1 1 1 1 1 1 1 1 1 4 4 4 4? 4? 4? 4? 4? 4? 4 2 2 1 1 1 1? 1? 1 1 1 1 3 2 1 4 1 1 1 1 1 1 3? E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 950 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Cu共UO2PO4兲2•8 H2O metatorbernite Vanadates YVO*⫹ 4 YVO*⫹ 4 Y.976Nd.024VO*⫹ 4 Y.95Tm.05VO*4 YVO*4 Gd.987Nd.013VO*⫹ 4 Gd.96Tm.04VO*⫹ 4 *⫹ Gd.7Er.3VO4 LuVO*4 Ca3 V2 O*⫹ 8 probable FE 1380 K *⫹ NaCa2 Mg2 V3 O12 *⫹ NaCa2 Mg2 V3 O12 *⫹ Sr5 V3 O12F Pb5 V2.63As.30P.07O12Cl*⫹ vanadinite, yellow 共Hillsboro, NM兲 Pb5 V2.96As.02P.02O12Cl*⫹ vanadinite, red 共Gila County, AZ兲 Arsenates YAsO*4 SmAsO*4 LuAsO*4 KTiOAsO*⫹ 4 KTiAsO*⫹ 4 KTiOAsO*⫹ 4 RbTiOAsO*⫹ 4 RbTiOAsO*⫹ 4 CsTiOAsO*⫹ 4 *⫹ KH2 AsO4 FE 97 K KH2 AsO*⫹ 4 FE 97 K RbH2 AsO*⫹ 4 FE 110 K CsH2 AsO*⫹ 4 FE 143 K Pb5 As3 O9 Cl⫹ finnemanite Pb4.95Ca.05As3 O12Cl*⫹ mimetite 共Wheal-Alfred, Cornwall兲 Pb4.92Ca.08As2.93P.07O12Cl*⫹ mimetite 共Tsumeb, SW Africa兲 NaD2AsO4•D2O*⫹ KH2 PO*⫹ 4 FE 123 K FL 220 K RbH2 PO*⫹ 4 FE 147 K FL 144 K RbH2 PO*⫹ 4 FE 147 K FL 144 K RbH2 PO*⫹ 4 FE 147 K FL 144 K PbHPO*4 FE 310 K NaH2PO4•H2O*⫹ NaH2PO4•2 H2O*⫹ Na2HPO4•7 H2O*⫹ Na2HPO4•12 H2O*⫹ Na4P2O7•10 H2O*⫹ Chemical composition, sample designations 1.70 1.72 1.83 1.7701 1.7708 1.7654 1.7934 1.7940 1.8441 1.5485 1.5446 1.5411 1.5511 2.1786 2.0619 2.0584 1.5362 1.9387 1.9330 1.9407 1.901 1.99 1.9468 1.9421 1.9521 1.97 1.8376 1.8741 1.8720 1.8067 2.2477 2.2596 1.9387 1.9330 1.9407 1.901 1.99 1.9468 1.9421 1.9521 1.97 1.8376 1.8741 1.8720 1.8067 2.2477 2.2596 1.70 1.72 1.83 1.7664 1.7679 1.7692 1.7883 1.7892 1.8341 1.5485 1.5446 1.5411 1.5511 2.1786 2.0619 2.0584 1.5212 1.4975 1.4936 1.4937 1.4874 1.782 1.4720 1.4507 1.4304 1.4231 1.4403 1.594 ny 1.4975 1.4936 1.4937 1.4874 1.782 1.4433 1.4296 1.4290 1.4193 1.4376 1.594 nx 1.76 1.73 1.85 1.8458 1.8470 1.8488 1.8591 1.8596 1.8953 1.5016 1.5016 1.5064 1.5310 2.1814 2.0459 2.0433 1.5423 2.1391 2.1322 2.1431 2.249 2.01 2.1547 2.1550 2.1576 2.00 1.8177 1.8741 1.8720 1.7911 2.2132 2.2190 1.4587 1.4662 1.4660 1.4661 1.846 1.4738 1.4679 1.4404 1.4239 1.4484 1.603 nz 1.8919 1.9342 1.9339 1.8576 2.4051 2.4112 1.8919 1.9342 1.9339 1.8576 2.4051 2.4112 1.8206 1.8210 1.8193 1.8450 1.8455 1.9023 1.5671 1.5630 1.5583 1.5688 2.2977 2.1469 2.1434 1.5535 2.0164 2.0145 2.0223 2.0164 2.0145 2.0223 1.8139 1.8150 1.8141 1.8358 1.8365 1.8866 1.5671 1.5630 1.5583 1.5688 2.2977 2.1469 2.1434 1.5381 2.0022 2.0011 1.9996 2.003 1.5093 1.5054 1.5054 1.5052 1.822 1.4852 1.4628 1.4423 1.4361 1.4524 1.624 nDy 2.0022 2.0011 1.9996 2.003 1.5093 1.5054 1.5054 1.5052 1.822 1.4556 1.4400 1.4411 1.4320 1.4499 1.624 nDx 1.9137 1.9144 1.9194 1.9279 1.9276 1.9698 1.5178 1.5164 1.5211 1.5472 2.2866 2.1282 2.1261 1.5606 1.8682 1.9342 1.9339 1.8416 2.3427 2.3469 2.2563 2.2566 2.2594 2.2285 2.2246 2.2269 2.419 1.4682 1.4764 1.4764 1.4767 1.885 1.4873 1.4814 1.4525 1.4373 1.4603 1.626 nDz 78.50 82.94 75.17 116.42 116.42 116.42 119.31 119.31 123.62 104.12 104.12 113.65 125.75 317.21 338.63 338.63 117.25 79.70 79.70 79.70 79.72 79.80 82.61 82.39 81.49 76.90 183.28 241.51 241.51 322.12 338.96 338.96 96.85 105.60 105.60 105.60 89.30 111.02 136.80 264.60 386.25 407.50 421.07 Vm 19.62 20.73 18.79 23.28 23.28 23.28 23.86 23.86 24.72 26.03 26.03 28.41 31.43 24.40 26.05 26.05 23.45 19.93 19.93 19.93 19.93 19.95 20.65 20.60 20.37 19.27 22.90 20.12 20.12 24.78 26.07 26.07 24.21 26.40 26.40 26.40 22.32 22.20 22.79 24.05 24.14 23.97 21.05 Vo 7.402 7.848 7.926 11.816 11.829 11.820 12.328 12.335 13.272 7.713 7.681 8.375 9.483 42.073 41.910 41.828 8.691 9.548 9.510 9.565 9.623 9.504 9.966 9.920 9.860 9.056 19.231 26.277 26.232 32.919 46.243 46.461 6.622 7.218 7.218 7.165 9.141 7.300 8.766 16.426 23.437 25.745 34.250 具 ␣ e典 0.0129 0.0128 0.0131 0.0124 0.0123 0.0122 0.0100 0.0098 0.0094 0.0093 0.0111 0.0106 0.0107 0.0099 0.0114 0.0115 0.0119 0.0118 0.0126 0.0121 0.0109 0.0113 0.0109 0.0102 0.0109 0.0095 0.0164 0.0076 0.0078 0.0078 0.0107 0.0093 0.0099 0.0096 0.0105 0.0119 0.0101 0.0121 具A典 0.4520 0.4511 0.4518 0.4378 0.4373 0.4084 0.7425 0.7467 0.7475 0.7222 0.2666 0.3097 0.3109 0.7406 0.4252 0.3981 0.3993 0.4454 0.2500 0.2473 0.3304 0.3320 0.3284 0.3349 0.3376 0.3338 0.3370 0.8322 0.8315 0.8316 0.8398 0.4447 0.8778 0.9097 0.9487 0.9782 0.9263 0.6447 具B典 7.48 7.51 7.42 7.51 7.53 7.31 10.87 11.05 11.29 11.14 6.19 6.84 6.82 10.95 7.72 7.42 7.32 7.77 5.62 5.71 6.95 6.85 6.94 7.26 7.05 7.51 5.74 13.19 13.07 13.03 11.21 8.73 11.93 12.28 12.03 11.45 12.09 9.24 具 Eo典 16.5 16.6 16.4 17.1 17.2 17.9 14.6 14.8 15.1 15.4 23.2 22.0 21.9 14.7 8.1 18.6 18.3 17.4 22.4 23.1 21.03 20.65 21.14 21.67 20.87 22.51 17.03 15.85 15.7 15.6 13.3 19.63 13.5 13.5 12.6 11.7 13.0 14.3 具 Ed典 76 87 76 93 95 94 93 96 93 64 87 87 87 62 31 31 62 90 97 78 93 76 95 95 95 76 78 97 97 95 31 31 64 67 67 67 88 62 62 62 62 62 62 Year JPCSAW JPCSAW JPCSAW PSISDG JOBPDE CRTEDF PSISDG JOBPDE PSISDG Ref. 11B FEROA8 FEROA8 FEROA8 Ref. 1 ZEKRDZ ZEKRDZ Ref. 1 REKEDA JOBPDE JAPIAU JAPNDE JPCSAW SJQEAF SJQEAF SJQEAF JPCSAW OPCOB8 JOBPDE JOBPDE Ref. 13 ZEKRDZ ZEKRDZ JOSAAH SPHCA6 SPHCA6 SPHCA6 JPSOAW Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Coden 72 72 72 Rf 77 77 Rf 37 48 37 1863 12 29 1863 13 1863 77 77 18 14 49 32 37 25 25 25 37 27 14 14 54 11 11 12 21 Rf Rf Rf Rf Rf Rf Vol 321 509 321 43 794 583 43 1935 43 187 95 95 95 288 437 437 2577 616 3299 5517 1651 321 1162 1162 1162 321 393 3299 3299 604 437 437 1215 711 711 383 1661 2577 2577 2577 2577 2577 317 Page 3 3 7 5 1 1 5 1 5 8 1 1 1 1 1 1 1 1 1 8 8 3 1 1 1 3 5 1 1 5 1 1 1 1 1 8 1 1 1 1 1 1 2 M 5 5 4 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3? 4 1 1 1 5 1 1 1 2 2 1 1 1 1 2? 4 1 1 1 1 1 4 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 951 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Na2HAsO4•7H2O* Mn6.5Ca.25Mg.25As2 O8 共OH兲*⫹ 8 allactite 共Langbanshuttan兲 Antimonates Ca1.0Na.8Mn.2Sb2 O*⫹ 7 atopite 共Miguel Burnier, Minas Gerais兲 Niobates LiNbO*⫹ 3 FE 1483 K FL 1470 K LiNbO*⫹ 3 Li:Nb ⫽ 0.946:1 共poled crystal兲 FE 1493 K FL 1470 K LiNbO*⫹ 3 共vapor-grown crystal兲 FE 1493 K LiNbO*⫹ 3 共congruent melt兲 FE 1493 K Li.97Mg.03NbO*⫹ 3 FE FL Li.95Mg.05NbO*⫹ 3 FE FL KNbO*⫹ 3 FE 691 K KNbO*⫹ 3 FE 691 K KNbO*⫹ 3 FE 691 K Sr2 Nb2 O*7 FE 1615 K Sr2 Nb2 O*7 FE 1615 K LaNbO*4 FL 792 K * Cs8 Nb22O59 Ba.25Sr.75Nb2 O*⫹ 6 FE 333 K Ba.25Sr.75Nb2 O*6 FE 333 K Ba.39Sr.61Nb2 O*6 FE 348 K Ba.39Sr.61Nb2 O*6 FE 348 K Ba.5Sr.5Nb2 O*⫹ 6 FE 403 K Ba.54Sr.46Nb2 O*6 FE Ba.67Sr.33Nb2 O*6 FE Ba.75Sr.25Nb2 O*6 FE 473 K *⫹ FE 703 K K3 Li2 Nb5 O15 *⫹ FE 418 K Sr4.25Na1.25Li.25Nb10O30 * Ba3 LaNb3 O12 *⫹ FE 833 K FL Ba2 NaNb5 O15 * FE 518 K Ba6 Ti2 Nb8 O30 *⫹ FE 813 K PbNb4 O11 PbMg.333Nb.666O*3 FE 265 K PbMg.333Nb.666O3 FE 400 K PbZn.333Nb.667O*3 FE 400 K *⫹ FE 723 K Pb2 KNb5 O15 Tantalates LiTaO*⫹ 3 FE 938 K FL 895 K LiTaO*⫹ 3 FE 938 K FL 895 K LiTaO*⫹ 3 共melt-grown兲 FE 938 K LiTa.92Nb.08O*⫹ 3 共melt-grown兲 FE LiTa.81Nb.19O*⫹ 3 共melt-grown兲 FE KTaO*⫹ 3 FE KTa.66Nb.34O*3 FE Chemical composition, sample designations 1.4512 1.7494 1.8016 2.2093 2.2040 2.2075 2.2044 2.2011 2.1994 2.2196 2.1877 2.1877 2.00 2.00 2.053 2.13 2.226 2.217 2.220 2.218 2.223 2.220 2.220 2.219 2.1697 2.2148 2.187 2.2238 2.219 2.2671 2.422 2.49 2.421 2.2712 2.1156 2.1167 2.1159 2.1263 2.1320 2.1413 2.191 1.8016 2.2093 2.2040 2.2075 2.2044 2.2011 2.1994 2.1879 2.0923 2.0923 2.09 2.09 2.136 2.13 2.226 2.217 2.220 2.218 2.223 2.220 2.220 2.219 2.1697 2.2237 2.187 2.2251 2.219 2.2637 2.422 2.49 2.421 2.3134 2.1156 2.1167 2.1159 2.1263 2.1320 2.1413 2.191 ny 1.4475 1.7300 nx 2.1193 2.1204 2.1203 2.1223 2.1266 2.1413 2.191 2.1311 2.1314 2.1218 2.1316 2.1235 2.1219 2.0931 2.2180 2.2180 2.09 2.09 2.036 2.08 2.167 2.205 2.191 2.195 2.193 2.186 2.182 2.228 2.0857 2.1911 2.049 2.1454 2.190 2.2908 2.422 2.49 2.421 2.3230 1.8016 1.4632 1.7490 nz 2.1859 2.1862 2.1863 2.1986 2.2057 2.2425 2.302 2.563 2.3883 2.563 2.4486 2.1859 2.1862 2.1863 2.1986 2.2057 2.2425 2.302 2.3036 2.3002 2.3010 2.2998 2.2949 2.2946 2.3504 2.2957 2.3478 2.06 2.06 2.105 2.25 2.326 2.328 2.327 2.330 2.327 2.328 2.329 2.330 2.2954 2.3228 2.270 2.3376 2.333 2.3844 2.581 1.8384 1.4657 1.7786 nDy 2.3036 2.3002 2.3010 2.2998 2.2949 2.2946 2.2968 2.1810 2.2952 2.17 2.17 2.200 2.25 2.326 2.328 2.327 2.330 2.327 2.328 2.329 2.330 2.2954 2.3347 2.270 2.3389 2.333 2.3819 2.581 1.8384 1.4622 1.7744 nDx 2.1902 2.1904 2.1912 2.1950 2.1987 2.2425 2.302 2.563 2.4623 2.2113 2.2144 2.2000 2.2138 2.2035 2.2027 2.1824 2.3487 2.1810 2.16 2.16 2.087 2.18 2.322 2.316 2.297 2.299 2.287 2.286 2.280 2.265 2.1755 2.2994 2.104 2.2295 2.294 2.4103 2.581 1.8384 1.4781 1.7787 nDz 52.85 52.85 52.85 52.97 52.97 63.40 63.41 53.03 53.08 53.08 53.08 53.03 53.03 64.72 64.72 64.72 149.35 150.95 83.29 1408.40 121.45 121.45 122.38 122.38 123.00 123.25 124.08 122.14 317.10 587.30 268.97 309.63 629.56 242.96 66.38 66.38 66.97 313.02 135.80 274.40 336.14 Vm 17.62 17.62 17.62 17.65 17.65 21.13 21.14 17.68 17.69 17.69 17.69 17.68 17.68 21.58 21.58 21.58 21.53 21.56 20.82 23.47 20.24 20.24 20.40 20.40 20.50 20.54 20.67 20.36 21.14 19.58 22.41 20.64 20.98 22.09 22.13 22.13 22.32 20.87 19.40 24.94 21.01 Vo 6.777 6.781 6.779 6.823 6.843 8.240 8.460 7.047 7.041 7.038 7.042 7.018 7.012 8.528 8.524 8.524 18.523 18.721 10.424 180.236 16.329 16.383 16.487 16.487 16.592 16.590 16.691 16.549 41.223 79.102 34.953 41.459 84.771 33.735 9.803 10.049 9.887 44.025 13.879 17.739 32.456 具 ␣ e典 0.0080 0.0079 0.0080 0.0081 0.0081 0.0107 0.0107 0.0091 0.0101 0.0088 0.0091 0.0088 0.0090 0.0089 0.0091 0.0109 0.0106 0.0108 0.0088 0.0088 0.0069 0.0124 0.0110 0.0102 0.0099 0.0101 0.0093 0.0098 0.0097 0.0079 0.0118 0.0101 0.0079 0.0098 0.0102 0.0097 0.0101 0.0087 0.0116 0.0081 具A典 0.2873 0.2869 0.2871 0.2845 0.2827 0.2789 0.2632 0.2057 0.2326 0.2659 0.2669 0.2673 0.2668 0.2684 0.2689 0.2715 0.2712 0.2718 0.3088 0.3088 0.3032 0.2893 0.2587 0.2565 0.2574 0.2575 0.2566 0.2579 0.2582 0.2540 0.2793 0.2576 0.2804 0.2614 0.2577 0.2398 0.2056 0.4452 0.8978 0.4865 具B典 7.58 7.63 7.57 7.50 7.48 6.47 6.29 6.02 6.06 6.94 6.86 6.98 6.89 6.94 6.89 6.32 6.39 6.35 7.49 7.49 8.37 6.12 6.14 6.34 6.45 6.38 6.64 6.50 6.52 7.16 6.17 6.39 7.55 6.53 6.35 6.28 5.71 9.05 11.14 9.82 具 Eo典 26.38 26.58 26.38 26.38 26.48 23.18 23.88 29.26 26.0 26.11 25.69 26.10 25.81 25.86 25.63 23.29 23.58 23.36 24.2 24.2 27.61 21 23.7 24.7 25.0 24.7 25.8 25.2 25.2 28.2 22.0 24.8 26.9 25.0 24.6 26.1 27.78 20.3 12.4 20.1 具 Ed典 65 96 77 77 77 76 66 67 74 90 76 91 92 92 74 74 97 89 70 78 68 84 84 96 68 84 84 68 71 81 86 70 73 71 74 76 81 75 33 62 33 Year JAPIAU JAPIAU JCRGAE JCRGAE JCRGAE JUPSUA JAPIAU JAPIAU JAPIAU IEJQA7 OPCOB8 SJQEAF CPLEEU JOBPDE JJAPA5 JJAPA5 FEROA8 JUPSUA OPSUA3 JCRGAE JAPIAU SPHCA6 SPHCA6 PSSABA JAPIAU SPHCA6 SPHCA6 JAPIAU Ref. 6 WHLPAR INOMAF PLRBAQ JPCSAW Ref. 6 SPSSA7 SPSSA7 Ref. 2C JAPIAU Ref. 10B Ref. 1 Ref. 10B Coden 36 80 42 42 42 41 37 15 18 Rf 46 30 22 2 34 38 45 26 17 21 9 9 13 13 203 58 28 43 39 29 29 154 39 29 29 39 Rf Vol 1674 6561 579 579 579 888 388 1941 3688 135 332 225 427 380 1362 1362 75 398 38 115 343 641 641 K5 343 641 641 343 517 1259 401 2709 1639 513 2006 1851 78K13 2361 392 2577 1181 Page 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 8 1 1 1 1 8 1 3 8 1 1 1 1 M 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 5 5 3 5? 3 3 3 3 3 3 3 4? 2 1 3 1 3 2 3 5 4 2 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume,V m , volume per O- atom, V O , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E O and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 952 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions thoreaulite La.294Sr.706Al.647Ta.353O*⫹ 3 共synthetic-Mateika兲 La.272Sr.728Al.648Ta.352O*⫹ 3 共synthetic-Hu兲 Nd.390Sr.610Al.695Ta.305O*⫹ 3 共synthetic-Mateika兲 * pyrochlore Pb2 Sc0.5Ta1.5O6.5 * Ba3 LaTa3 O12 SbNb.43Ta.57O*⫹ 4 stibiotantalite, probably FE 673 K SbNb.69Ta.31O*⫹ 4 stibiotantalite, probably FE 673 K Sulfates Na2 SO*⫹ 4 thenardite 共synthetic?兲 K2 SO*⫹ 4 arcanite 共synthetic?兲 FL? Rb2 SO*⫹ 4 Cs2 SO*⫹ 4 *⫹ Tl2 SO4 CaSO*⫹ 4 anhydrite SrSO*⫹ 4 celestite BaSO*⫹ 4 barite PbSO*⫹ 4 anglesite PbSO*⫹ 4 anglesite 共Monte Poni兲 Fe2 共SO4 兲*3 Fe2 共SO4 兲*3 orthorhombic in LB but probably monoclinic KLiSO*4 FL 190, 900, 940 K RbLiSO*⫹ 4 Phase IV, RT FE 439 K K2 Mg2 共SO4 兲*⫹ 3 langbeinite K2 Co2 共SO4 兲*⫹ 3 FL K2 Cd2 共SO4 兲*3 FL 430 K Rb2 Cd2 共SO4 兲*⫹ 3 FE 129 K FL 129 K Tl2 Cd2 共SO4 兲*⫹ 3 FE 129 K FL 128 K FeSO4 OH* Li2 SO4•H2 O*⫹ MgSO4 •7 H2 O*⫹ epsomite CaSO4 •2 H2 O*⫹ gypsum FeSO4 OH•2 H2 O* butlerite 共synthetic兲 Fe2 共SO4 兲3 •7 H2 O* cornellite 共synthetic兲 NiSO4 •6 H2 O*⫹ retgersite 共synthetic兲 CuSO4 •5 H2 O*⫹ chalcanthite 共synthetic兲 Pr2 共SO4 兲3 •8 H2 O*⫹ Nd2 共SO4 兲3 •8 H2 O*⫹ Sm2 共SO4 兲3 •8 H2 O* K2 UO2 共SO4 兲2 •2 H2 O* K2 Mg共SO4 兲2 •6 H2 O*⫹ K2 Fe共SO4 兲2 •6 H2 O*⫹ K2 Co共SO4 兲2 •6 H2 O*⫹ K2 Ni共SO4 兲2 • H2 O*⫹ K2 Cu共SO4 兲2 •6 H2 O*⫹ SnTa2 O*6 Chemical composition, sample designations 2.309 1.9846 1.9838 1.9922 2.292 2.100 2.2835 2.2907 1.4635 1.4855 1.5031 1.5517 1.8188 1.5640 1.6109 1.6240 1.8465 1.8451 1.701 1.738 1.4634 1.4718 1.5243 1.5886 1.577 1.5795 1.7029 1.734 1.4672 1.4440 1.5113 1.633 1.553 1.4973 1.5225 1.5348 1.5360 1.5369 1.510 1.4523 1.4709 1.4754 1.4803 1.4738 1.4573 1.4843 1.5031 1.5474 1.8124 1.5586 1.6092 1.6229 1.8414 1.8403 1.701 1.727 1.4634 1.4700 1.5243 1.5886 1.575 1.5795 1.7029 1.727 1.4522 1.4225 1.5094 1.557 1.545 1.4973 1.5008 1.5258 1.5274 1.5288 1.499 1.4500 1.4649 1.4695 1.4724 1.4713 ny 2.268 1.9846 1.9838 1.9922 2.292 2.100 2.2624 2.2797 nx 1.4768 1.4879 1.5042 1.5534 1.8349 1.6011 1.6174 1.6340 1.8566 1.8560 1.692 1.742 1.4623 1.4700 1.5243 1.5886 1.577 1.5795 1.7029 1.825 1.4761 1.4486 1.5190 1.681 1.593 1.4746 1.5288 1.5450 1.5467 1.5477 1.545 1.4641 1.4851 1.4884 1.4923 1.4891 2.372 1.9846 1.9838 1.9937 2.292 1.972 2.3344 2.3319 nz 1.4669 1.4934 1.5131 1.5598 1.8604 1.5698 1.6214 1.6362 1.8780 1.8775 1.770 1.802 1.4722 1.4796 1.5341 1.6074 1.590 1.5936 1.7296 1.783 1.4615 1.4326 1.5207 1.587 1.572 1.5107 1.5140 1.5399 1.5412 1.5427 1.514 1.4606 1.4757 1.4806 1.4835 1.4835 2.388 2.0256 2.0243 1.8212 2.477 2.161 2.3744 2.3976 nDx 1.4730 1.4947 1.5133 1.5644 1.8676 1.5755 1.6231 1.6374 1.8834 1.8827 1.770 1.814 1.4722 1.4818 1.5341 1.6074 1.592 1.5936 1.7296 1.805 1.4765 1.4555 1.5227 1.678 1.586 1.5107 1.5367 1.5493 1.5503 1.5521 1.527 1.4628 1.4821 1.4864 1.4916 1.4863 2.418 2.0256 2.0243 1.8212 2.477 2.161 2.4045 2.4193 nDy 1.4809 1.4973 1.5144 1.5662 1.8857 1.6137 1.6303 1.6480 1.8945 1.8943 1.760 1.818 1.4717 1.4804 1.5341 1.6074 1.593 1.5936 1.7296 1.917 1.4863 1.4607 1.5304 1.749 1.640 1.4870 1.5436 1.5608 1.5619 1.5629 1.571 1.4754 1.4969 1.5001 1.5050 1.5019 2.499 2.0256 2.0243 1.8224 2.477 2.021 2.4575 2.4592 nDz 88.57 108.76 122.13 141.28 123.56 76.40 76.79 86.66 79.59 79.59 217.17 205.80 98.94 105.10 243.97 244.25 266.89 279.60 279.96 84.02 103.63 243.47 123.65 132.75 387.47 210.72 181.27 419.68 417.50 417.03 291.37 330.20 332.69 328.88 323.40 327.50 115.64 57.89 57.77 56.76 150.56 269.13 80.28 78.03 Vm 22.14 27.19 30.53 35.32 30.89 19.10 19.20 21.66 19.90 19.90 18.09 17.15 24.74 26.27 20.33 20.35 22.23 23.31 23.26 16.80 20.73 22.13 20.61 18.96 20.39 21.07 20.14 20.98 20.87 20.85 24.28 23.59 23.76 23.49 23.10 23.39 16.52 19.19 19.26 18.91 23.16 22.43 20.07 19.51 Vo 5.855 7.453 8.626 10.758 12.863 6.023 6.377 7.333 8.475 8.468 19.994 19.726 6.506 7.008 17.829 19.640 21.095 22.199 25.915 8.270 6.841 15.269 8.876 11.185 30.072 14.537 13.100 31.202 31.113 31.131 21.078 21.407 22.306 22.215 21.998 22.134 16.362 6.839 6.821 6.742 21.077 33.324 11.246 10.966 具 ␣ e典 0.0074 0.0064 0.0065 0.0067 0.0109 0.0057 0.0053 0.0055 0.0078 0.0079 0.0206 0.0203 0.0069 0.0074 0.0058 0.0087 0.0075 0.0067 0.0084 0.0181 0.0072 0.0096 0.0070 0.0180 0.0172 0.0088 0.0085 0.0082 0.0081 0.0082 0.0114 0.0085 0.0082 0.0081 0.0080 0.0089 0.0091 0.0062 0.0062 0.0074 0.0139 0.0073 0.0095 0.0098 具A典 0.8750 0.8279 0.7933 0.7117 0.4311 0.6769 0.6250 0.6072 0.4140 0.4146 0.5307 0.4967 0.8768 0.8602 0.7555 0.6563 0.6737 0.6689 0.5264 0.4773 0.8725 0.9364 0.7754 0.6167 0.6935 0.8206 0.7683 0.7368 0.7347 0.7328 0.7681 0.8943 0.8539 0.8451 0.8362 0.8443 0.2294 0.3402 0.3407 0.4528 0.2348 0.3108 0.2350 0.2330 具B典 13.78 14.37 13.96 13.02 7.97 13.74 13.69 13.27 9.21 9.14 6.41 6.26 14.26 13.63 14.42 11.01 11.99 12.60 10.00 6.49 13.87 12.51 13.28 7.40 8.03 12.19 12.04 12.01 12.07 11.94 10.36 12.97 12.89 12.92 12.93 12.32 6.34 9.33 9.37 9.88 5.19 8.27 6.30 6.18 具 Eo典 15.75 17.3 17.5 18.3 18.4 20.30 21.91 21.85 22.25 22.05 12.0 12.6 16.26 15.8 19.0 16.7 17.7 18.8 18.9 13.60 15.9 13.3 17.1 11.9 11.5 14.8 15.6 16.2 16.4 16.3 13.4 14.5 15.1 15.2 15.4 14.5 27.6 27.43 27.51 21.81 22.1 26.6 26.83 26.52 具 Ed典 34 62 62 62 08 11 11 62 11 23 22 22 29 94 87 87 84 87 87 22 67 62 62 22 22 62 42 62 62 62 19 62 13 62 62 62 60 97 01 97 98 86 06 06 Year ZEKRDZ Ref. 1 Ref. 1 Ref. 1 ZEKRDZ ZEKRDZ ZEKRDZ Ref. 1 ZEKRDZ ZEKRDZ JACSAT JACSAT ZEKRDZ OPSUA3 SPHCA6 SPHCA6 SPSSA7 SPHCA6 SPHCA6 JACSAT JAPIAU Ref. 1 Ref. 1 JACSAT JACSAT Ref. 1 SMPTA8 Ref. 1 Ref. 1 Ref. 1 CIWPAV Ref. 1 ZEKRDZ Ref. 1 Ref. 1 Ref. 1 Ref. 10D JOBPDE CPLEEU JOBPDE CRTEDF INOMAF AJSCAP AJSCAP Coden 87 Rf Rf Rf 44 49 49 Rf 49 58 44 44 71 75 32 32 26 32 32 44 38 Rf Rf 44 44 Rf 22 Rf Rf Rf 298 Rf 52 Rf Rf Rf 14 18 14 33 22 22 22 Vol 43 2742 1567 2742 138 14 14 4046 14 460 1965 1965 141 473 76 76 2222 76 76 1965 4365 2533 2652 1965 1965 2737 1 1769 1769 1769 207 2743 433 2743 4088 2743 390 3299 278 3299 119 1208 61 61 Page M 1 1 1 1 1 1 1 1 1 1 2 2 1 8 1 1 1 1 1 2 1 1 1 2 2 1 1 1 1 1 8 1 1 1 1 1 1 1 1 1 1 1 1 1 E 1 1 1 1 1 1 1 1 1 1 3 3 1 2 1 1 3 1 1 3 1 1 1 3 3 2 1 2 2 2 5 1 1 1 1 1 3 1 1 1 4 3 2 2 TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 953 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions *⫹ K2 Zn共SO4 兲2 •6 H2 O Rb2 Mg共SO4 兲2 •6 H2 O*⫹ Rb2 Fe共SO4 兲2 •6 H2 O*⫹ Rb2 Co共SO4 兲2 •6 H2 O*⫹ Rb2 Ni共SO4 兲2 •6 H2 O*⫹ Rb2 Cu共SO4 兲2 •6 H2 O*⫹ Rb2 Zn共SO4 兲2 •6 H2 O*⫹ Cs2 Mg共SO4 兲2 •6 H2 O*⫹ Cs2 Mn共SO4 兲2 •6 H2 O*⫹ Cs2 Fe共SO4 兲2 •6 H2 O*⫹ Cs2 Co共SO4 兲2 •6 H2 O*⫹ Cs2 Cu共SO4 兲2 •6 H2 O*⫹ Cs2 Zn共SO4 兲2 •6 H2 O*⫹ Tl2 Fe共SO4 兲2 •6 H2 O*⫹ Tl2 Co共SO4 兲2 •6 H2 O*⫹ Tl2 Ni共SO4 兲2 •6 H2 O*⫹ Tl2 Cu共SO4 兲2 •6 H2 O*⫹ Tl2Zn共SO4兲2•6 H2O*⫹ NaAl共SO4 兲2 •12 H2O*⫹ KAl共SO4 兲2 •12 H2O*⫹ KAl共SO4 兲2 •12 H2O*⫹ KCr共SO4 兲2 •12 H2O KFe共SO4 兲2 •12 H2O KGa共SO4 兲2 •12 H2O RbAl共SO4 兲2 •12 H2O RbCr共SO4 兲2 •12 H2O RbFe共SO4 兲2 •12 H2O RbGa共SO4 兲2 •12 H2O RbIn共SO4 兲2 •12 H2O CsAl共SO4 兲2 •12 H2O CsCr共SO4 兲2 •12 H2O CsFe共SO4 兲2 •12 H2O CsGa共SO4 兲2 •12 H2O CsIn共SO4 兲2 •12 H2O TlAl共SO4 兲2 •12 H2O TlCr共SO4 兲2 •12 H2 O TlFe共SO4 兲2 •12 H2O TlGa共SO4 兲2 •12 H2O Selenites and Selenates LiHSeO*3 K2 SeO*⫹ 4 FE 93 K Rb2 SeO*⫹ 4 SeO*⫹ 4 *⫹ Tl2 SeO4 Chemical composition, sample designations 1.4720 1.4583 1.4760 1.4806 1.4845 1.4785 1.4771 1.4743 1.4847 1.4917 1.4967 1.4934 1.4930 1.5866 1.5942 1.6001 1.5866 1.5866 1.4274 1.4447 1.4453 1.4685 1.4657 1.4538 1.4453 1.4682 1.4662 1.4541 1.4517 1.4473 1.4682 1.4679 1.4534 1.4531 1.4827 1.5060 1.5043 1.4916 1.632 1.5247 1.5391 1.5830 1.8922 1.561 1.5212 1.5369 1.5827 1.8834 ny 1.4667 1.4567 1.4701 1.4750 1.4780 1.4767 1.4723 1.4739 1.4830 1.4887 1.4938 1.4920 1.4904 1.5711 1.5789 1.5847 1.5767 1.5723 1.4274 1.4447 1.4453 1.4685 1.4657 1.4538 1.4453 1.4682 1.4662 1.4541 1.4517 1.4473 1.4682 1.4679 1.4534 1.4531 1.4827 1.5060 1.5043 1.4916 nx 1.643 1.5301 1.5434 1.5834 1.8976 1.4844 1.4671 1.4859 1.4897 1.4932 1.4910 1.4857 1.4802 1.4903 1.4974 1.5010 1.5024 1.4971 1.5918 1.5996 1.6047 1.5958 1.5934 1.4274 1.4447 1.4453 1.4685 1.4657 1.4538 1.4453 1.4682 1.4662 1.4541 1.4517 1.4473 1.4682 1.4679 1.4534 1.4531 1.4827 1.5060 1.5043 1.4916 nz 1.580 1.5352 1.5515 1.5991 1.9490 1.4774 1.4672 1.4815 1.4858 1.4895 1.4886 1.4833 1.4855 1.4946 1.5003 1.5055 1.5047 1.5021 1.5930 1.6010 1.6025 1.5997 1.5930 1.4387 1.4562 1.4560 1.4813 1.4815 1.4653 1.4565 1.4814 1.4822 1.4657 1.4637 1.4585 1.4809 1.4836 1.4648 1.4652 1.4974 1.5226 1.5234 1.5066 nDx 1.655 1.5390 1.5538 1.5998 1.9588 1.4832 1.4689 1.4873 1.4915 1.4960 1.4906 1.4883 1.4857 1.4964 1.5035 1.5084 1.5061 1.5047 1.6093 1.6176 1.6186 1.6097 1.6092 1.4387 1.4562 1.4560 1.4813 1.4815 1.4653 1.4565 1.4814 1.4822 1.4657 1.4637 1.4585 1.4809 1.4836 1.4648 1.4652 1.4974 1.5226 1.5234 1.5066 nDy 1.669 1.5446 1.5583 1.6002 1.9636 1.4967 1.4780 1.4977 1.5012 1.5051 1.5036 1.4975 1.4915 1.5024 1.5093 1.5130 1.5152 1.5092 1.6166 1.6238 1.6225 1.6191 1.6166 1.4387 1.4562 1.4560 1.4813 1.4815 1.4653 1.4565 1.4814 1.4822 1.4657 1.4637 1.4585 1.4809 1.4836 1.4648 1.4652 1.4974 1.5226 1.5234 1.5066 nDz 73.80 120.10 133.26 152.48 132.19 327.13 344.94 346.80 341.76 339.74 343.00 343.24 364.50 373.04 368.06 363.40 363.70 363.89 346.79 343.19 338.78 344.00 342.82 455.43 449.28 449.28 453.51 458.89 452.40 458.78 462.84 467.60 462.05 479.66 471.94 477.23 480.59 476.72 492.39 457.32 461.03 466.00 463.85 Vm 24.60 30.02 33.31 38.12 33.05 23.37 24.64 24.77 24.41 24.27 24.50 24.52 26.04 26.64 26.29 25.96 25.98 25.99 24.77 24.51 24.20 24.57 24.49 22.78 22.46 22.46 22.67 22.94 22.62 22.94 23.14 23.38 23.10 23.98 23.60 23.86 24.03 23.84 24.62 22.87 23.05 23.30 23.19 Vo 6.125 8.791 9.978 12.166 14.580 21.963 22.584 23.408 23.251 23.255 23.347 23.210 24.549 25.569 25.519 25.394 25.361 25.269 27.675 27.683 27.538 27.575 27.394 27.938 28.530 28.563 30.124 30.325 29.236 29.167 30.727 30.929 29.877 30.874 30.121 31.682 31.888 30.785 31.778 31.164 32.700 32.958 32.104 具 ␣ e典 0.0096 0.0084 0.0081 0.0078 0.0121 0.0082 0.0082 0.0082 0.0078 0.0081 0.0085 0.0081 0.0082 0.0081 0.0079 0.0078 0.0084 0.0079 0.0108 0.0105 0.0081 0.0106 0.0103 0.0101 0.0096 0.0088 0.0095 0.0118 0.0091 0.0092 0.0098 0.0119 0.0092 0.0096 0.0091 0.0095 0.0117 0.0091 0.0096 0.0102 0.0105 0.0120 0.0100 具A典 0.6288 0.7539 0.7294 0.6640 0.3882 0.8522 0.8822 0.8458 0.8365 0.8294 0.8359 0.8436 0.8482 0.8277 0.8145 0.8055 0.8079 0.8127 0.6640 0.6534 0.6458 0.6595 0.6627 0.9638 0.9199 0.9183 0.8646 0.8708 0.8981 0.9183 0.8653 0.8697 0.8974 0.9030 0.9135 0.8654 0.8661 0.8990 0.8997 0.8345 0.7887 0.7918 0.8165 具B典 10.25 12.00 11.98 11.65 7.16 12.86 13.10 12.83 13.10 12.83 12.51 12.95 12.85 12.78 12.84 12.87 12.40 12.80 9.94 9.96 11.32 9.95 10.16 12.34 12.40 12.88 12.10 10.88 12.54 12.62 11.90 10.83 12.50 12.24 12.64 12.07 10.90 12.59 12.24 11.42 10.97 10.26 11.41 具 Eo典 16.30 15.9 16.4 17.5 18.4 15.0 14.8 15.1 15.6 15.4 14.9 15.3 15.1 15.4 15.7 15.9 15.3 15.7 14.9 15.2 17.5 15.0 15.3 12.8 13.4 14.0 13.9 12.4 13.9 13.7 13.7 12.4 13.9 13.5 13.8 13.9 12.5 14.0 13.6 13.6 13.9 12.9 13.9 具 Ed典 84 62 62 62 08 62 62 13 62 62 62 62 62 62 13 62 62 62 62 62 62 62 10 62 62 33 62 62 62 62 62 62 62 62 62 62 62 62 62 62 62 62 62 Year ZEKRDZ Ref. 1 Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 PPSAAM Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Ref. 1 Coden 169 Rf Rf Rf 44 Rf Rf 52 Rf Rf Rf Rf Rf Rf 52 Rf Rf Rf Rf Rf Rf Rf 83 Rf Rf 85 Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Rf Vol 249 2744 2744 2744 138 2743 2743 433 2743 2743 2743 2743 2743 2743 433 2743 2743 2743 1572 1571 1571 1572 211 3797 3798 169 189 189 189 189 189 189 189 189 189 189 189 189 189 189 189 189 189 Page M 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 E 3 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1? 1 1 1 1? 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E O and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 954 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions Cs2 NiSeO4 •6 H2 O*⫹ ZnSeO4 •6 H2 O*⫹ K2 Mg共SeO4 兲2 •6 H2O*⫹ K2 Cu共SeO4 兲2 •6 H2O*⫹ Rb2 Mg共SeO4 兲2 •6 H2O*⫹ Cs2 Mg共SeO4 兲2 •6 H2O*⫹ KAl共SeO4 兲2 •12 H2O KAl共SeO4 兲2 •12 H2O Molybdates CaMoO*⫹ 4 CaMoO*⫹ 4 CaMoO*⫹ 4 *⫹ SrMoO4 SrMoO*⫹ 4 CdMoO*⫹ 4 PbMoO*⫹ 4 wulfenite *⫹ PbMoO4 wulfenite PbMoO*⫹ 4 wulfenite PbMoO*⫹ 4 wulfenite Pb2 MoO*⫹ 5 * Bi6 Mo2 O15 * Bi2 Mo3 O12 * Bi2 Mo3 O12 ⫹ Ce2 Mo3 O12 ⫹ FL 1233 K Nd2 Mo3 O12 *⫹ FE 432 K FL 432 K Gd2 Mo3 O12 *⫹ FE 432 K FL 432 K Gd2 Mo3 O12 *⫹ FE 435 K Tb2 Mo3 O12 Li.286Gd.571MoO*⫹ 4 Tungstates *⫹ CaWO4 CaWO*⫹ 4 CaWO*⫹ 4 SrWO*⫹ 4 BaWO*⫹ 4 ZnWO*⫹ 4 ZnWO*⫹ 4 ZnWO*⫹ 4 *⫹ PbWO4 stolzite PbWO*4 NaY共WO4 兲2 NaLa共WO4 兲2 Chlorates and Perchlorates NaClO*⫹ 3 Chemical composition, sample designations 1.5226 1.5132 1.4855 1.5034 1.4894 1.5039 1.4666 1.4663 1.9287 1.9432 1.9367 1.8649 1.8628 2.1292 2.2508 2.2525 2.2491 2.2371 2.0936 2.222 2.187 2.047 1.9657 1.9622 1.8018 1.7990 1.8095 1.9922 1.8816 1.8812 1.8828 1.8289 1.8102 2.1201 2.1198 2.1164 2.1622 2.155 1.94 1.93 1.5022 1.9287 1.9432 1.9367 1.8649 1.8628 2.1292 2.2508 2.2525 2.2491 2.2371 2.0848 2.233 2.165 2.065 1.9657 1.9622 1.8014 1.7990 1.8090 1.9922 1.8816 1.8812 1.8828 1.8289 1.8102 2.1058 2.1018 2.1026 2.1622 2.155 1.94 1.93 1.5022 ny 1.5226 1.5132 1.4832 1.4954 1.4876 1.5036 1.4666 1.4663 nx 1.5022 1.8951 1.8948 1.8958 1.8368 1.8077 2.2475 2.2467 2.2435 2.1009 2.112 1.94 1.92 1.9345 1.9479 1.9441 1.8670 1.8654 2.1062 2.1705 2.1853 2.1756 2.1684 2.1944 2.197 2.265 2.245 1.9567 1.9618 1.8492 1.8461 1.8556 1.9838 1.4969 1.4890 1.4995 1.5161 1.4991 1.5093 1.4666 1.4663 nz 1.5152 1.9196 1.9184 1.9203 1.8618 1.8426 2.1767 2.1740 2.1756 2.2704 2.246 1.94 1.94 1.9789 1.9916 1.9909 1.9083 1.9078 2.2190 2.4152 2.4061 2.4103 2.4090 2.1885 2.370 2.284 2.210 2.0347 2.0186 1.8445 1.8427 1.8538 2.0567 1.5391 1.5288 1.4967 1.5098 1.5011 1.5177 1.4806 1.4800 nDx 1.5152 1.9196 1.9184 1.9203 1.8618 1.8426 2.1934 2.1925 2.1935 2.2704 2.246 1.94 1.94 1.9789 1.9916 1.9909 1.9083 1.9078 2.2190 2.4152 2.4061 2.4103 2.4090 2.1965 2.361 2.329 2.182 2.0347 2.0186 1.8449 1.8427 1.8542 2.0567 1.5391 1.5288 1.4991 1.5182 1.5030 1.5178 1.4806 1.4800 nDy 1.5152 1.9359 1.9347 1.9359 1.8719 1.8405 2.3412 2.3386 2.3403 2.1817 2.170 1.95 1.96 1.9891 2.0012 2.0005 1.9132 1.9125 2.1916 2.2788 2.2830 2.2795 2.2767 2.3260 2.323 2.478 2.424 2.0221 2.0168 1.8983 1.8964 1.9063 2.0489 1.5122 1.5036 1.5138 1.5318 1.5134 1.5235 1.4806 1.4800 nDz 23.69 20.79 166.35 71.08 19.53 19.53 19.53 21.73 25.22 16.58 16.58 16.58 22.23 22.23 20.53 24.12 24.12 23.84 19.04 246.36 289.50 289.50 286.17 77.44 78.10 78.10 78.10 86.91 100.90 66.33 66.33 66.33 88.92 88.92 19.51 19.51 19.51 21.65 21.65 18.59 22.36 22.36 22.36 22.36 27.59 24.44 20.05 20.05 22.08 22.29 24.89 24.66 25.96 27.52 23.75 23.75 Vo 78.03 78.03 78.03 86.62 86.62 74.37 89.42 89.42 89.42 89.42 137.97 366.59 240.62 240.62 220.82 222.92 348.42 345.30 363.55 385.24 475.04 475.04 Vm 5.009 18.856 8.580 8.577 8.587 9.124 10.386 8.698 8.690 8.681 11.560 11.553 28.652 30.016 29.942 29.862 9.178 8.871 8.963 8.927 9.359 9.344 9.561 12.128 12.164 12.131 12.070 17.765 49.557 32.341 30.891 15.872 15.788 24.023 24.449 25.181 27.306 31.444 31.427 具 ␣ e典 0.0084 0.0074 0.0073 0.0073 0.0074 0.0076 0.0082 0.0082 0.0086 0.0104 0.0086 0.0009 0.0038 0.0088 0.0083 0.0091 0.0088 0.0091 0.0098 0.0126 0.0117 0.0123 0.0132 0.0121 0.0120 0.0139 0.0160 0.0105 0.0088 0.0101 0.0104 0.0103 0.0095 0.0098 0.0097 0.0093 0.0095 0.0092 0.0089 0.0104 0.0103 具A典 0.7959 0.3911 0.3913 0.3905 0.4247 0.4398 0.2747 0.2753 0.2759 0.2790 0.2794 0.3620 0.3692 0.3667 0.3594 0.3623 0.4032 0.4043 0.2857 0.2538 0.2519 0.2535 0.2565 0.2855 0.2554 0.2591 0.2890 0.3506 0.3509 0.4346 0.4365 0.4297 0.3381 0.7744 0.7908 0.8210 0.7909 0.8156 0.7894 0.8689 0.8696 具B典 12.32 9.17 9.25 9.23 9.58 9.64 7.31 7.32 7.17 6.55 7.23 25.76 12.39 8.17 8.35 7.96 8.54 8.41 6.84 5.67 5.88 5.74 5.57 6.15 5.84 5.47 5.37 7.29 7.97 8.29 8.21 8.17 7.53 11.22 11.43 11.85 11.53 11.90 11.89 11.54 11.63 具 Eo典 15.48 23.44 23.65 23.63 22.55 21.9 26.60 26.58 26.00 23.49 25.87 71.17 33.5 22.28 23.22 21.98 21.17 20.80 23.94 22.35 23.33 22.62 21.72 21.5 22.8 21.1 18.5 20.80 22.7 19.0 18.8 19.0 22.27 14.4 14.4 14.4 14.5 14.5 15.0 13.2 13.3 具 Ed典 10 65 63 77 77 77 65 64 89 77 97 72 72 78 65 77 65 77 77 78 62 62 77 70 74 74 99 23 23 71 79 86 77 62 62 62 23 62 62 33 62 Year NJGAAY JAPIAU JOSAAH SJOTBH SJOTBH SJOTBH JAPIAU APOPAI WLHPAR SJOTBH NIMAER INOMAF INOMAF Ref. 7 JAPIAU SJOTBH JAPIAU SJOTBH SJOTBH Ref. 7 Ref. 1 Ref. 1 SJOTBH JOSAAH MRBUAC MRBUAC Ref. 15 ZEKRDZ ZEKRDZ Ref. 6 Ref. 2B Ref. 3 SPHCA6 Ref. 1 Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Ref. 1 ZEKRDZ Ref. 1 Coden 29 36 53 44 44 44 36 3 38 44 385 8 8 22 Rf 58 58 Rf Rf 44 60 9 9 36 44 36 44 44 Rf Rf Rf 58 Rf Rf 85 Rf Vol 53 1674 1286 542 542 542 1674 1084 670 542 209 1957 1957 7-79 1674 542 1674 542 542 7-94 353 2810 542 1375 41 41 525 226 226 511 69N5 155 371 2737 2737 2112 40 2112 2112 169 189 Page 1 1 1 1 1 1 1 1 1 1 8 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8 1 8 1 1 1 1 1 1 1 5 8 M 1 1 1 1 1 1 1 1 1 1 4? 5? 5 1 1? 1 1 1 1 1 1 1 1 2 4 4 2 1 1? 1 1 1 1 2 2 1 1 1 1 1 1 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume, V m , volume per O atom, V o , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E o and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued REFRACTIVE INDEX AND DISPERSION 955 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions 1.4647 1.4616 1.4696 1.6202 1.5894 1.4711 1.5954 1.789 1.8414 1.8439 1.7831 1.7812 1.5917 1.9078 1.549 1.509 1.5910 1.5782 1.5954 1.789 1.8414 1.8439 1.6629 1.6627 1.5917 1.7986 1.589 1.545 1.5867 1.5715 ny 1.4640 1.4606 1.4661 1.6186 1.5560 1.4711 nx 1.482 1.5997 1.5876 1.7041 1.7065 1.7855 1.7834 1.6129 1.9248 1.587 1.5954 1.835 1.4678 1.4645 1.4711 1.6288 1.6089 1.4281 nz 8 Interference method. Brewster method. Unknown or other. E Error. M Method. 7 6 *Composition well-known – synthetic crystals or analyzed minerals. ⫹ Refractive index accurate to ⫾ 0.0001–0.0010. 1 Prism method. 2 Immersion method. 3 Reflectivity data, classical oscillator model, Kramers-Kronig analysis. 4 Ellipsometry method. 5 Critical angle method. LiClO4 •3 H2 O*⫹ Bromates NaBrO*⫹ 3 AgBrO3 Iodates and Periodates LiIO3 -alpha*⫹ LiIO3 -alpha*⫹ KIO3 -alpha*⫹ KIO3 -alpha*⫹ KIO*⫹ 4 HIO*⫹ 3 ⫽ alpha iodic acid ⫽ IO2 OH KIO2 F*2 Chromates MgCrO4•7 H2O Cs2Mg共CrO4兲2•6 H2O*⫹ Rb2Mg共CrO4兲2•6 H2O*⫹ KClO*⫹ 4 RbClO*⫹ 4 CsClO*⫹ 4 TlClO*⫹ 4 Sr共ClO3 兲⫹ 2 Chemical composition, sample designations 1.568 1.6376 1.6224 1.8868 1.8870 1.6976 1.6968 1.6205 1.8436 1.615 1.6168 1.847 1.4730 1.4691 1.4752 1.6427 1.5667 1.4832 nDx 1.550 1.6432 1.6338 1.8868 1.8870 1.8342 1.8334 1.6205 1.9687 1.565 1.6168 1.847 1.4736 1.4701 1.4788 1.6446 1.6045 1.4832 nDy 245.97 381.95 359.98 67.18 67.18 88.90 88.90 103.46 62.99 105.18 75.14 74.54 90.96 100.91 115.97 102.10 134.31 140.73 Vm 22.36 27.28 25.70 22.59 22.59 29.63 29.63 25.86 21.00 26.29 25.14 24.84 22.74 25.22 28.99 25.52 22.38 20.10 Vo 17.620 30.876 28.564 6.828 6.844 8.593 8.581 8.436 6.870 8.298 6.099 7.637 6.009 6.626 7.709 8.590 10.742 9.146 具 ␣ e典 0.0209 0.0227 0.0244 0.0100 0.0095 0.0124 0.0126 0.0133 0.0111 0.0104 0.0096 0.0149 0.0068 0.0066 0.0068 0.0100 0.0066 0.0090 具A典 0.7800 0.6511 0.6697 0.4539 0.4521 0.4941 0.4952 0.6428 0.3986 0.6761 0.6471 0.4436 0.8713 0.8786 0.8637 0.6126 0.6628 0.8933 具B典 7.73 6.77 6.63 8.51 8.75 7.97 7.94 8.78 7.57 10.22 10.39 6.90 14.35 14.64 14.21 9.90 12.69 12.61 具 Eo典 9.9 10.4 9.9 18.75 19.34 16.13 16.04 13.6 18.99 15.1 16.05 15.55 16.47 16.6 16.4 16.1 19.1 14.1 Ed典 1 Error limits. 0.0001–0.0005. 2 0.0006 –0.0010. 3 0.0011–0.0050. 4 0.0051–0.0100. 5 ⬎ 0.0100. 6 Not given. 7 Doubtful. ? Dispersion, A, not consistent with like compounds or structural family trends. ?? Probably contains Fe. 1.521 1.6555 1.6444 1.7390 1.7394 1.8379 1.8363 1.6476 1.9956 1.611 1.6168 1.920 1.4768 1.4732 1.4804 1.6542 1.6256 1.4384 nDz 31 12 12 77 76 96 92 62 68 74 10 31 26 26 26 34 62 96 Year Ref. 11A MNLMBB MNLMBB OPCOB8 PLRBAQ Ref. 2D CPLEEU Ref. 1 APPLAB JCPSA6 NJGAAY Ref. 11A PPSAAM PPSAAM PPSAAM ZEKRDZ Ref. 1 JAPIAU Coden 16 16 23 14 Rf 9 Rf 12 60 29 111 111 111 87 Rf 80 Vol 228 175 175 279 1693 87Y4 77 466 186 2470 53 205 462 462 462 43 4065 6097 Page 2 1 1 1 1 1 1 8 1 1 1 2 1 1 1 1 1 5 M 5 1 1 1 1 1 1 1 1 3 1 3 1 1 1 1 1 2 E TABLE 1. Refractive index and dispersion data, listing refractive indices 共n x , n y , n z兲 at ⫽ ⬁, refractive indices 共n Dx , n Dy , n Dz兲 at ⫽ 589.3 nm, molar volume,V m , volume per O- atom, V O , and mean values of electronic polarizabilities 具␣e典, mean dispersion values 具 A 典 and 具 B 典 according to Eq. 共3a兲, and average of E O and E d according to Eq. 共3b兲. Source references use Codens from the American Chemical Society, Chemical Abstracts Service Source Index 1907–1999 Cumulative 共American Chemical Society, Washington, DC, 2000兲. 共Symbols * and ⫹ and numerical values for method and error can be found at the end of the table.兲—Continued 956 SHANNON ET AL. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION 957 TABLE 2. Comparison of n ⬁ values determined by prism methods and reflectivity methods Compound MgF2 CaF2 SrF2 BaF2 ZnF2 PbF2 P42 /mnm Fm3m Fm3m Fm3m P42 /mnm Fm3m KMgF3 KNiF3 KMnF3 Pm3n Pm3n Pm3n RbMnF3 Cu2 O Pm3n Pn3m ZnO EuO Al2 O3 Er2 O3 Fm3̄m R3̄c Ia3̄ SiO2 GeO2 P31 21 P42/mnm TiO2 P42/mnm ThO2 Fm3̄m CeO2 UO2 Fm3̄m Fm3̄m Tb3 Ga5 O12 Y3 Fe5 O12 Be2 SiO4 Mg2 SiO4 Bi4 Si3 O12 Bi4 Ge3 O12 YVO4 PbMg.33Nb.67O3 a Deltaa Delta Delta IR-prism ellips-prism Interf-prism Space group Prism method Reflectivity Error Ellipsometer Error Interference method 具 n ⬁典 具 n ⬁典 具 n ⬁典 Ia3̄d R3̄ Pmnb I41 /amd Pm3m 1.3761 1.4255 1.4306 1.4655 1.4963 1.7248 1.7272 1.3975 1.4382 2.27 1.9150 1.904 1.960 1.7496 1.923 1.930 1.5353 1.9546 1.957 2.506 2.490 2.0679 2.07 2.12 2.16 1.9335 2.1287 2.165 1.6448 1.6455 1.6365 1.9674 2.0267 2.0338 2.0055 1.9994 2.422 1.38 1.430 1.44 1.47 1.503 1.58 1.58 1.43 1.52 1.44 1.45 1.59 2.54 2.55 2.57 ⬎.01 0.01 ⬎.01 ⬎.01 0.01 ⬎.01 ⬎.01 0.05 0.05 0.01 0.05 0.05 0.02 0.05 0.05 1.4827 1.4745 1.903 1.903 2.30 1.78 0.08 1.538 2.05 0.005 ⫺0.012 ⫺0.001 0.003 0.003 0.34 0.03 1.7480 1.95 1.95 ⫺0.05 ⫺0.03 0.02 0.02 0.01 0.01 0.13 0.13 2.36 0.05 0.23 1.932 2.15 2.15 1.66 1.66 1.650 0.02 0.02 0.01 0.01 0.005 0.01 0.01 ⫺0.001 0.002 0.02 0.01 0.014 1.9559 2.0218 2.00 2.00 2.49 ⫺0.002 0.03 0.02 0.003 0.09 0.09 2.46 2.46 2.20 2.20 2.31 2.35 0.00 0.00 0.01 0.00 0.01 À0.14 À0.14 0.03 0.04 0.00 0.01 0.12 0.27 0.28 0.30 0.001 ⫺0.01 0.00 0.07 ⫺0.011 ⫺0.005 ⫺0.012 Boldfaced values refer to discrepancies greater than experimental values. of the plot at ⫽⬁, gives n ⬁ ⫽(1⫹1/B) 1/2. In Appendix 2, we give alternative forms of this equation. The n ⬁ values derived from Eq. 共3a兲 are necessary for the correct application of the Lorenz–Lorentz relation to obtain ion polarizabilities. The values of n ⬁ derived in this paper from one-term Sellmeier analyses of data from the visible region results in n ⬁ that comes only from electronic transitions. This n ⬁ is distinctly different from the dielectric n ⬁ derived from the dielectric constant o⫽n ⬁2 , obtained in the kHz–MHz region where both lattice vibrations and electronic transitions contribute to the dielectric constant. This is shown graphically by Tropf et al. 共1995兲 in their Fig. 1, p. 33.13 and is illustrated numerically by the value of refractive indices of quartz where from optical data, 具 n ⬁ 典 ⫽1.547, and from dielectric constant data at 1 kHz, 具 n ⬁ 典 ⫽2.135 共Shannon, 1993兲. An alternative form 关Wemple and DiDomenico 共1971兲; Wemple 共1973, 1977兲兴 is n 2 ⫺1⫽E dE o /„E 2o ⫺ 共 ប …2 兲 , 共3b兲 where in a single oscillator model ប ⫽the photon energy, E o⫽the average single oscillator 共Sellmeier兲 energy gap in eV, and E d ⫽ the average oscillator strength in eV, which measures the average strength of interband optical transitions and E d is related to physical parameters by the expression E d⫽  N cZ aN e , where N c is the cation coordination number, Z a is the formal valence of the anion, N e is the effective J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 958 TABLE 3. Inconsistent dispersion values 具A典 Compound NaF Cs2 SiF6 Na2 GeF6 Cs2 GeF6 BaMgF4 Cu2 O Y2 O3 Y2 O3 Y2 O3 As2 O3 Sb2 O3 SrB4 O7 Gd.99Nd.01Al3 B4 O12 MgAl2 O4 共1.15% Co兲 SrLaAlO4 Gd3 Sc2 Al3 O12 Y3 Ga5 O12 Tm3 Ga5 O12 LaEr3 ScGa3 O12 SrGdGa3 O7 Y3 Fe5 O12 SiO2 ZrSiO4 Al2 SiO4 F2 Mn2 SiO4 CaMnSiO4 Fe1.7Mn.1Mg.2SiO4 Zn2 SiO4 ZrSiO4 Al2 SiO5 Ca2.7Mg.2Fe.1Al1.8Fe.2Si3 O12 Ca2 CoSi2 O7 Li.95Na.05Al.95Fe.05Si2 O6 CaTiSiO5 CaTiSiO5 Na4 Al3 Si3 O12Cl Na4 Al3 Si3 O12Cl K.9Na.1AlSi3 O8 KAlSi3 O8 Ba.93K.04Na.02Al2 Si2 O8 Ca3 Si2 O6 共OH兲2 共OH2 兲2 Ca2 Al2 FeSi3 O12OH Cu6 Si6 O18•6 H2O Pb9 Mg9 Si9 O24共OH兲24 Ca共UO2 兲共UOOH兲共SiO4 兲共SiO3 OH兲•4 H2O Ca共UO2 兲共UOOH兲共SiO4 兲共SiO3 OH)•4 H2O Ba1.99Nd.01ZnGe2 O7 TiO2 TiO2 SrTiO2.929 PbTiO3 PbTiO3 ThO2 Mineral cuprite arsenolite senarmontite spinel smoky quartz zircon topaz tephroite fayalite willemite zircon sillimanite grossular spodumene titanite titanite sodalite sodalite adularia microcline paracelsian afwillite epidote dioptase molybdophyllite beta-uranophane beta-uranophane rutile rutile ceramic ceramic RbH2 PO4 DyPO4 HoPO4 ErPO4 TmPO4 YbPO4 Reference ⫺16 10 2 m Eo Ed 共eV兲 共eV兲 Accuracy indexa 具A典 78 Ref. 7 7-105 35 ZPCBAL 31 292 82 INOMAF 18 570 35 ZPCBAL 31 292 75 JAPIAU 46 4645 79 JJAPA5 18 1043 91 Ref. 9 1079 91 Ref. 9 1079 56 ANCHAM 28 2023 62 Ref. 1 Rf 2565 62 Ref. 1 Rf 204 95 OMATET 4 669 96 98 101 117 75 86 126 62 53 87 80 40 15.0 13.4 14.4 11.7 13.8 5.5 7.1 9.9 10.8 9.6 8.0 14.3 11.1 12.2 11.0 11.8 15.3 33.9 18.0 25.8 27.6 19.0 25.0 28.2 2 3 2 3 3 5 2 2 3 3 5 1 high high high high high low high low low low low low 98 62 96 73 87 82 84 91 65 40 48 39 66 80 70 42 94 271 14.0 13.1 12.2 9.8 8.9 9.2 11.7 8.7 4.0 28.8 25.4 33.6 24.5 22.5 24.8 32.5 19.5 14.8 1 1 5 5 3 3 2 3 3 low low low high high high low high high 97 NJMIAK 11 259 62 Ref. 1 Rf 514 62 Ref. 1 Rf 4071 32 AMMIAY 17 135 76 69 37 98 12.5 9.4 16.3 8.8 16.9 24.6 26.7 18.5 1 1 1 3 high high low high 32 AMMIAY 17 135 09 ZEKRDZ 46 138 23 ZEKRDZ 58 460 03 ZEKRDZ 37 235 62 Ref. 1 Rf 4085 62 Ref. 1 Rf 235 97 JOBPDE 14 3299 13 ZEKRDZ 13 294 97 Ref. 10A 1609 97 Ref. 10A 1609 62 Ref. 1 Rf 2597 97 Ref. 10A 885 21 TTMMDZ 35 231 62 Ref. 1 Rf 2966 42 MNLMBB 26 231 25 MNLMBB 20 277 62 Ref. 1 Rf 2983 62 Ref. 1 Rf 2889 38 Ref. 10C 368 39 AMMIAY 24 324 39 AMMIAY 24 324 90 JOBPDE 7 1190 97 OPLEDP 22 1808 79 JJAPA5 18 1043 95 SPHCA6 40 640 71 Ref. 6 513 77 APOPAI 16 3210 64 OPACAT 11 287 90 85 81 64 67 35 178 51 73 91 65 98 63 85 87 44 59 66 80 50 66 66 152 84 87 92 92 44 9.9 9.2 10.5 9.7 11.8 15.0 7.6 13.3 9.2 8.3 14.5 11.8 14.1 12.2 11.3 15.0 11.6 11.8 9.7 13.4 11.8 11.0 4.6 6.3 6.6 5.7 5.7 10.5 17.9 20.5 18.9 25.7 20.3 30.7 11.8 23.4 23.8 21.1 17.0 13.7 18.0 15.5 16.3 24.1 23.4 20.6 20.5 24.0 20.6 22.0 23.0 30.3 28.1 30.5 30.6 34.5 3 1 1 1 1 1 1 2 4 2 2 2 1 1 2 2 1 1 1 3 3 3? 5 5 1 2 3 3 high high high high high low high low low low low high low high high low low low low ? ? low high low low low low low 67 00 00 00 00 00 107 57 56 48 55 48 11.2 12.0 12.2 13.2 12.3 13.1 13.3 23.3 23.5 25.4 23.5 25.3 2 4 4 4 4 4 high low low low low low CHSCBU 43 1973 Ref. 1 Rf 173 PSSBBD 195 625 JAPIAU 44 1395 Ref. 5 314 JCRGAE 57 600 SPHCA6 29 704 JOBPDE 8 1668 BJAPJA 16 475 SPHCA6 12 383 OMATET 15 103 OMATET 15 103 OMATET 15 103 OMATET 15 103 OMATET 15 103 J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION 959 TABLE 3. Inconsistent dispersion values—Continued 具A典 Compound LuPO4 GdP5 O14 ErP5 O14 Li1.93Na.04Mg.02Al2 P2 O8 共F.9OH1.1兲 Y.95Tm.05VO4 Cs8 Nb22O59 Ba.75Sr.25Nb2 O6 KAl共SO4 ) 2 •12 H2O Tl2 Ni共SO4 ) 2 •6 H2O CaMoO4 Nd2 Mo3 O12 PbWO4 NaY共WO4 兲2 a Mineral montebrasite stolzite Reference 10 ⫺16 m 2 Eo Ed 共eV兲 共eV兲 Accuracy indexa 具A典 00 OMATET 15 103 87 WLHPAR 36 823 87 WLHPAR 36 823 46 AMMIAY 31 51 93 JAPNDE 32 1651 78 JCRGAE 43 115 68 JAPIAU 39 343 54 114 27 47 164 124 79 12.4 9.5 19.6 14.8 5.7 6.1 7.2 23.8 14.6 30.6 22.9 17.0 21.1 28.2 4 1 1 3 3 5 4 low high low low high high low 62 62 65 23 97 72 96 81 83 88 86 9 12.4 11.3 8.4 8.0 7.2 25.8 13.5 17.5 23.2 22.7 25.9 71.2 1 1 1 1 4 5 high low low low low low Ref. 1 Rf 3798 Ref. 1 Rf 1571 JAPIAU 36 1674 ZDKRDZ 58 226 NIMAER 385 209 INOMAF 8 1957 Accuracy index defined in Table 1. number of valence electrons/anion,  ⫽0.26 for ionic compounds, and  ⫽0.37 for covalent compounds. These parameters were analyzed for more than 100 compounds byWemple and DiDomenico 共1971兲. The scheme was found to work well for simple single-bond halides and oxides as well as a number of more complex multibond oxides containing two cations of differing coordination. However, it was necessary to assume covalent character (  ⫽0.37) for scheelitetype molybdates and tungstates and several iodates and carbonates. In this paper we consider both single-bond and multibond oxides and fluorides. In general, dispersion parameters are not identical for light polarized along the different axes of uniaxial and biaxial crystals. This results in dispersion parameters that vary with the crystal orientation. However, for simplicity in the tables, we list only mean values of 具 A 典 , 具 B 典 , 具 E o典 , and 具 E d典 . In the text following, although we omit the brackets, all values of A, B, E o , and E d are understood to be mean values. When numerical values were given, we have used those data to determine the one-term Sellmeier parameters 关Eq. FIG. 1. Mean dispersion value 具 A 典 vs frequency of occurrence. 共3a兲兴. When data were presented in the form of different Sellmeier equations, we used the equations to calculate numerical dispersion data for use in Eq. 共3a兲 and when data were provided only in graphical form, the dispersion data were taken from these plots. 2.4. Error Limits Where possible, we have given error limits as reported; when no error limits were reported, we have either stated that or estimated the errors. Following the composition, the symbol ⫹ refers to compounds with the most reliable refractive indices, generally with ␦ n⫽⫾0.0001– 0.0005. When refractive indices are quoted to four decimal places in LandoltBörnstein, as for example for the many sulfates studied by Tutton over the years 1890–1930, we have assumed error limits of ⫾0.0001– 0.0005. Estimated error limits are only valid for the refractive index and do not take errors in composition into consideration. Crystals studied before the early FIG. 2. Dispersion A vs average Sellmeier energy gap E o . J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 960 1900s and for which four significant figures are quoted in the original papers are assumed to be measured by prism methods. 3. Results and Discussion Table 1 provides 73 measurements on 55 fluorides, 9 measurements on chlorides, and 750 measurements on 509 oxides. In the table we give the specimen composition and source, the refractive indices at ⫽⬁ and 589.3 nm, molar volume V m , volume per anion V o , electronic polarizabilities ␣ e , the mean dispersion parameters, A, B, E o, and E d , along with indices that provide an indication of the method of measuring n, the estimated error in n, the reliability of the composition and refractive index data, and source reference in an easily accessible form. FIG. 3. Dispersion A vs average oscillator strength. 3.1. Comparison of Data Using Different Methods Teller 共LST兲 relation. Similarly, the high value for n ⬁ (RbMnF3 ) was noted by Perry and Young 共1967兲. The three IR values of n ⬁ (Cu2 O)⫽2.54, 2.55, and 2.57, obtained from the IR measurements, agree reasonably well and are probably more accurate than the value of n ⬁ (Cu2 O)⫽2.27 obtained from prism data in LB. This value derived from data determined in 1871 appears systematically low compared with the IR values and the 643.8 nm value of 2.89 determined by Medenbach and Shannon 共1997兲. In Table 2 we compare the results of determinations of n ⬁ by prism, IR, ellipsometer, and interference methods. In general, results obtained for prism or interference and IR methods are identical within experimental error. Exceptions are PbF2 , RbMnF3 , Cu2 O, EuO, GeO2 , ThO2 , UO2 , and PbMg.33Nb.67O3 , as noted by boldfaced values in Table 2. The discrepancy in n ⬁ (PbF2 ) was noted by Axe et al. 共1965兲 and attributed to an inadequacy of the Lyddane–Sachs– TABLE 4. Dispersion parameters for oxides and fluorides: Transition metal Compound 3⫹ Fe 3d 5 Chemical composition Mineral hematite lepidocrocite goethite 具A典b 具Eo 典c 具Ed 典c Atom 共%兲a 10⫺16 m2 共eV兲 共eV兲 226 215 162 206 181 180 172 197–160 120–117 115–101 122 114 3.6 5.0 5.1 6.4 6.5 7.4 8.0 4.8–5.3 10.3–10.9 7.7–8.1 8.0 8.4 19.7 15.0 19.3 12.1 13.6 12.0 11.6 17.0–19.0 12.6 18.1–19.4 16.5 16.7 Fe2 O3 FeOOH FeOOH Fe2 共SO4 兲3 FeSO4 OH FeSO4 OH•2 H2O Fe2 共SO4 兲3 •7 H2O Y3 Fe5 O12 MFe共SO4 兲2 •12 H2O Ca3 Fe2 Si3 O12 Na.87Fe.92Al.05Ti.03Si2 O6 Na.7Ca.2Mg.1Fe.9Si2 O6 butlerite cornellite garnet M⫽K,Rb,Cs,Tl andradite aegirine aegirine 40 33 33 12 14 33 27 25 54 10 9 9 Cr3⫹ 3d 3 MCr共SO4兲2 •12 H2O M⫽K,Rb,Cs,Tl 54 105–95 11.0–12.1 13.8–14.0 Mn3⫹ 3d 4 Ca3 Mn1.95共SiO4 兲2.1共O4 H4 兲.9 henritermierite 12 105 8.4 18.2 Co2⫹ 3d 7 Ca2 CoSi2 O7 Sr2 CoSi2 O7 8 8 178 117 7.6 9.1 11.8 15.0 Ni2⫹ 3d 8 NiF2 MNiF3 33 20 198 77–71 8.0 13.3–13.7 10.1 15.7–16.4 M⫽K,Cs Eu2⫹ 4f 7 Eu2 SiO4 - beta 28 162 6.5 15.2 U4⫹ 5f 2 UO2 33 264,210 4.2,4.5 14.5,16.7 Why low 具 A 典 ? F Atom % ⫽共total ‘‘soft ions’’⫹H2 O兲/共total cations⫹anions兲. b Boldfaced values of 具 A 典 are relatively high. c Boldfaced values of 具 E o典 and 具 E d典 are relatively low. a J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION 961 TABLE 5. Dispersion parameters for oxides and fluorides d 10 Atom Compound ⫹ Cu 3d 10 Cu2 O CuCl Zn 3d 10 ZnO ZnWO4 Zn2 SiO4 Ca2 ZnSi2 O7 BaZnF4 CaY1.92Nd.08Zn2 Ge3 O12 Zn4 O共BO2 兲6 ZnF2 As5⫹ 3d 10 I7⫹ 4d 10 Chemical composition KH2 AsO4 RbH2 AsO4 CsH2 AsO4 Mn6.5Ca.25Mg.25As2 O8 共OH兲8 Mineral cuprite willemite hardystonite allactite KIO4 共%兲 a 具A典b ⫺16 10 2 m b 具Eo 典c 具Ed 典c Why low 共eV兲 共eV兲 具A典? 67 50 267 161 3.8 6.3 15.8 15.9 50 33 28 8 53 10 17 33 185–159 86– 82 71 71 67 67 61 59 5.74–6.09 7.2–7.3 11.1 11.5 13.8 9.8 11.5 14.8 15.1–16.5 26.0–26.6 20.3 19.7–19.8 17.3 24.4 22.7 18.4 16 16 16 8 98–100 94 93 81 10.9–11.0 11.3 11.1 9.8 14.6–14.8 15.1 15.4 20.2 17 133 8.8 13.7 Si Ca, Si Ba, F Ca F Ca, Mg Atom % ⫽共total ‘‘soft ions’’⫹H2 O兲/共total cations⫹anions兲. Boldfaced values of 具 A 典 are relatively high. c Boldfaced values of 具 E o典 and 具 E d典 are relatively low. a b There is a large discrepancy between the EuO prism value of n⫽1.96 quoted by Wachter 共1968兲 and the IR value of 2.30 from Axe 共1969兲. An alternative method of deciding which of these is more correct is to use the data from  -Eu2 SiO4 along with the additivity rule 关Eq. 共2兲兴 where the total polarizability ␣ e (  -Eu2 SiO4 ) is 10.19 A3 共see Table 1兲. Subtracting ␣ e(SiO2 )⫽2.803 A3 , we arrive at ␣ e (EuO) ⫽3.69 A3 , which corresponds to n ⬁ ⫽1.87, much closer to the prism value n ⬁ ⫽1.96 than the IR value. The large discrepancy between prism and IR data from GeO2 is probably caused by poor data or IR analysis. This is evident from the n ⬁ (GeO2 ) IR values of n o⫽2.02 and n e ⫽2.10, which are improbably larger than n ⬁ (SnO2 ) prism values of n o⫽1.9442 and n e⫽2.0449. The IR values of n ⬁ (ThO2 )⫽2.20 and n ⬁ (UO2 )⫽2.33 by Axe and Pettit 共1966兲 are significantly larger than the value of 2.070 obtained by Ellis and Lindstrom 共1964兲 for ThO2 and the UO2 value of 2.16 by Ellis 共1964兲 using prism methods. Axe and Pettit noted this fact and attributed the discrepancy to an inadequacy of the LST relation. The final example of the deviation of IR results from prism methods concerning PbMg.33Nb.67O3 where IR data give 2.49 共Karamyan, 1976兲 and prism method results in a value of n ⬁ ⫽2.422 共Kamzina, 1974兲. Here the results may be within experimental error since the errors were not given. 3.2. Comparison of Dispersion Values An independent method of checking accuracy is to compare dispersion constants A with values from like compounds and from trends in structural families. The value of A is perhaps as sensitive a test for accuracy as estimated errors in n. Table 3 shows a number of examples of inconsistencies in A. Some examples of like-compound discrepancies are Cs2 SiF6 , Cs2 GeF6 , Y2 O3, SiO2 , TiO2 , ThO2 , BaMgF4 , Zn2 SiO4 , Mn2 SiO4 , Y3 Ga5 O12 , Ca3 Al2 Si3 O12 , CaTiSiO5 , YVO4 , CaMoO4 , PbWO4 , and KAl共SO4 ) 2 •12 H2 O. Examples of deviations from structural family trends are Na2 GeF6 in the M2 GeF6 family (M⫽Na,Rb,Cs兲, Y3 Ga5 O12 in the M3 Ga5 O12 garnet family 共M⫽Y,Nd,Dy,Ho,Tm兲, Ba.75Sr.25Nb2 O6 in the Ba1⫺x Srx Nb2 O6 family, Tl2 Ni共SO4 ) 2 •6 H2 O in the Tl2 M共SO4 ) 2 •6 H2 O family 共M⫽Fe,Co,Cu,Ni兲, and KAl共SO4 ) 2 •12 H2 O in the alum family MAl共SO4 ) 2 •12 H2 O 共M⫽K, Rb兲. The samples which show values differing substantially from the values in like compounds and values shown in family trends have been marked in Table 1 with a question mark following the accuracy index, as defined in Table 1. In the example of Y2 O3 , the value of A⫽75⫻10⫺16 m2 is consistent with accurate RE2 O3 values from Sc2 O3 (66 ⫻10⫺16 m2 ), Lu2 O3 (66⫻10⫺16 m2 ), Yb2 O3 (68– 69 ⫻10⫺16 m2 ), and Dy2 O3 (73⫻10⫺16 m2 ). The measurements for the outliers Y2 O3 of 125, 62, and 53⫻10⫺16 m2 probably resulted from systematic errors that influence A more than n ⬁ . The dispersion parameter A for Y.95Tm.05VO4 of 164⫻10⫺16 m2 关Ohta et al. 共1993兲兴 seems high in light of the values of 109 and 102⫻10⫺16 m2 for YVO4 关Kuwano and Saito 共1990兲; Medenbach and Shannon 共1997兲兴 and 98 ⫻10⫺16 m2 for Y.98Nd.02VO4 关Lonheim and DeShazer 共1978兲兴. Similarly, the dispersion value for Ba.75Sr.25Nb2 O6 of 79⫻10⫺16 m2 seems inconsistently lower than the values of 102– 93⫻10⫺16 m2 observed for other members of the family Ba1⫺x Srx Nb2 O6 . The value 79 was derived from only two values of n at 633 and 1050 nm 关Venturini et al. 共1968兲兴; the value at 1050 nm is perhaps out of range of validity for the Sellmeier equation. Dispersion from eight samples of tiJ. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 962 TABLE 6. Dispersion parameters for oxides and fluorides p 6 Compound 4⫹ Ti 3p 6 Chemical composition TiO2 TiO2 TiO2 Li2 Ti3 O7 CaTiO3 SrTiO3 BaTiO3 Ba.77Ca.23TiO3 PbTiO3 MTiOPO4 MTiOAsO4 CaTiSiO5 Pb1 – x Lax Zr1 – y Tiy O3 Ba2 TiSi2 O8 V5⫹ 3p 6 V2 O5 YVO4 NaCa2 Mg2 V3 O12 Sr5 V3 O12F Ca3 V2 O8 GdVO4 Cr6⫹ 3p 6 M2 Mg共CrO4 兲2 •6 H2O MgCrO4 •7 H2O Nb5⫹ 4p 6 Cs8 Nb22O59 KNbO3 MNbB2 O6 KTa.66Nb.33O3 K3 Li2 Nb5 O15 Ba6 Ti2 Nb8 O30 Pb2 KNb5 O15 Ba2 NaNb5 O15 Sr4.25Na1.25Li.25Nb10O30 Ba1-x Srx Nb2 O6 LiNbO3 Sr2 Nb2 O7 Ba3 LaNb3 O12 LaNbO4 Mo6⫹ 4p 6 Ta5⫹ 5p 6 W6⫹ 5p 6 Ba2⫹ 5p 6 PbMoO4 Bi2 Mo3 O12 Ce2 Mo3 O12 Gd2 Mo3 O12 Tb2 Mo3 O12 CdMoO4 Li2.86Gd.57MoO4 SrMoO4 CaMoO4 Mineral rutile anatase brookite M⫽K,Rb M⫽K,Rb,Cs fresnoite M⫽Rb,Cs M⫽K,Rb wulfenite KTaO3 LiTa1-x Nbx O3 Ba3 LaTa3 O12 PbWO4 CaWO4 SrWO4 BaWO4 ZnWO4 BaO BaBe2 Si2 O7 BaAl2 Si2 O8 Ba2 MgGe2 O7 stolzite barylite paracelsian Atom 具A典b 具Eo 典c 共%兲a 10⫺16 m2 共eV兲 具Ed 典c c 共eV兲 Why low 具 A 典 ? Ba 33 33 33 25 20 20 20 20 40 12 12 12 20–16 8 119–111 119–114 107 122 120 131–115 110–109 115 112 133–128 131–122 120–104 102–93 71 5.1–5.2 5.4–5.5 5.5 5.9 5.7 5.5–5.8 5.9 5.8 5.1 7.6 7.3–7.5 7.4–7.7 5.5–6.1 10.5 26.3–27.4 24.8 –25.5 27.3 22.1 23.4 22.3–24.0 24.7–24.9 23.9 28.1 15.8–16.5 16.4–17.9 18.1–20.1 27.6 –29.9 21.3 28 17 15 14 15 16 264 109–95 119–115 118 114 113–109 4.1 5.7–7.5 7.3–7.4 7.8 7.7 6.8–7.0 14.7 20.9–22.5 18.3–18.7 17.4 18.2 20.7–21.1 42 61 227–244 209 6.6–6.8 7.7 9.9–10.4 9.9 24 20 10 20 25 21 30 43 21 22 20 18 31 17 124 109–106 127–117 107 118 102 101 98 101 110–93 91–88 88 79 69 6.1 6.3–6.4 7.9–8.2 6.3 6.2 6.3 6.1 6.5 6.4 6.1–6.6 6.9–7.0 7.5 7.6 8.4 21.1 23.3–23.4 16.0–16.7 23.9 22.1 24.7 26.1 25.0 24.8 23.7–25.9 25.7–26.1 24.3 26.9 27.6 Li Sr Ba La 17 42 42 42 42 33 12 16 16 132–117 160–139 105 104–101 103 98 95 91–88 91–88 5.6–5.9 5.4–5.5 7.3 8.2–8.3 8.2 6.8 7.5 8.4–8.5 8.0–8.2 21.7–22.3 21.1 20.8 18.8 –19.1 19.0 23.9 22.3 20.8 –21.2 22.0–22.3 Sr Ca 20 20 16 107 81–79 73 6.5 7.5–7.6 8.3 23.2 26.4 –26.6 26.6 Li Ba 33 17 17 33 33 104 73–74 74 76 82 6.6 9.2 9.6 9.6 7.3 23.5 23.4 –23.6 22.6 21.9 26.6 50 8 8 17 116 96 87 84 7.2 9.6 11.3 10.1 19.2 17.2 16.3 18.9 Sr Ba Ba Ba J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION 963 TABLE 6. Dispersion parameters for oxides and fluorides p 6 —Continued Compound Chemical composition Mineral BaO SrO CaO MgO U6⫹ 6p 6 Cu共UO2 PO4兲2 . 8 H2O K2 UO2 共SO4 兲2 •2 H2O Ca共UO2 兲共UOOH兲SiO4 共SiO3 OH兲•4 H2O metatorbernite beta-uranophane Atom 共%兲a 具A典b 10 ⫺16 m2 具 E o典 c 具 E d典 c 50 50 50 50 116 95 80 64 7.2 8.5 9.4 11.3 19.2 19.9 21.2 22.0 40 18 33 121 114 66 9.2 10.4 11.8 14.3 13.5 20.6 共eV兲 共eV兲 Why low 具 A 典 ? Atom % ⫽共total ‘‘soft ions’’⫹H2 O兲/共total cations⫹anions兲. Boldfaced values of 具 A 典 are relatively high. c Boldfaced values of 具 E o典 and 具 E d典 are relatively low. a b tanite with a nominal composition CaTiSiO5 showed an unusually large variation with values ranging from 73 to 120 ⫻10⫺16 m2 . This is perhaps not surprising in light of the presence of twinning in most samples and a variation in composition with analyzed compositions ranging from Ca.75Ti1.05Si1.07O5 to Ca1.0Ti0.98Mn0.05Si0.99O5 关Hintze 共1897兲兴. However, we have judged the values of 73 and 91 in CaTiSiO5 from Eisbruckalp in Pfunders, Tirol and Glimmerschiefer in St. Gotthard to be lower than expected for titanites. Although many of the outliers, such as Cs2 SiF6 , Cs2 GeF6 , RbH2 PO4 , Mn2 SiO4 , PbWO4 , Gd3 Sc2 Al3 O12 , and CaTiSiO5 have lower reported accuracies, others were reported to have good accuracy, i.e., ␦n ⫽⫾0.0001– 0.0005. Although the dispersion value for CaTiO3 (127⫻10⫺16 m2 ) quoted from Driscoll and Vaughn7 共Table 1兲 is consistent with the values of A from SrTiO3 and BaTiO3 , the values of n ⬁ of 1.5554 and 1.3304 are far too low. The value of n ⬁ of 2.261 obtained using the Chaulnes method by Linz and Herrington 共1958兲 is more reasonable, suggesting either a calculation error or that the value obtained by Driscoll and Vaughn7 was from a compound other than CaTiO3 . 3.3. Analysis of Dispersion Values Dispersion values A range from ⬃40 to 260⫻10⫺16 m2 . Their distribution is shown in Fig. 1. The largest number of values is centered around 60⫻10⫺16 m2 with a second distribution centered around 90– 100⫻10⫺16 m2 and much smaller numbers distributed over the range 140– 250 ⫻10⫺16 m2 . For convenience we arbitrarily call the range from 50 to 80 ‘‘normal dispersion,’’ and 80 to 250 ‘‘high dispersion.’’ In this section we make an effort to rationalize the high dispersion values A. As a framework for the analysis of dispersion parameters, we use the analysis of Wemple and DiDomenico 共1971兲 and Wemple 共1977兲. In this scheme A is proportional to 1/E oE d , where E o⫽the average single oscillator energy and E d⫽the oscillator strength which measures the average strength of interband optical transitions. According to DiDomenico and Wemple 共1971兲, E d is related to physical parameters by the expression E d⫽  N cZ aN e , 共4兲 where N c is the cation coordination number, Z a is the formal valence of the anion, N e is the effective number of valence electrons/anion,  ⫽0.26 for ionic compounds, and  ⫽0.37 for covalent compounds. Using this scheme high dispersion values should result for compounds with: 共1兲 共2兲 共3兲 共4兲 共5兲 low energy gaps, ionic character, cations having low N c , fluoride rather than oxide anions; and cations with low N e . DiDomenico and Wemple 共1969兲 and Wemple 共1977兲 concentrated primarily on optical dielectric constants 共refractive indices兲 and their relationships to the above variables but they were not concerned specifically with dispersion, although DiDomenico and Wemple 共1969兲 noted that the refractive index dispersion is approximately inversely related to the average single oscillator Sellmeier gap E o . In this section we focus primarily on the dispersion A and the relationship to chemical composition and electron configuration of the atoms involved and find that many of the trends in A can be explained by the above five factors. Wemple and DiDomenico 共1971兲 and Wemple 共1977兲 showed that low values of E o are associated with the d 10 cations Cu⫹ and Ag⫹ , and the s 2 cations As3⫹ , Te4⫹ , I5⫹ , Tl⫹ , Pb2⫹ , and Bi3⫹ . Figures 2 and 3 show plots of A vs E o and A vs E d ,respectively. The plot of A vs E o shows a better fit to 1/E o than 1/E d which we interpret to mean that variations in E o are more important in explaining dispersion than variations in E d . We shall analyze this assumption in Secs. 3.3.1– 3.3.5. A survey of the dispersion parameters of the compounds in Table 1 shows high dispersion values A associated with certain ions which we call ‘‘soft’’ ions, i.e., s 2 , p 6 , d 10 and transition metal ions, H2 O, and crystalline hydrates. In Tables 4 – 8 we have listed the dispersion parameters A, E o , and E d of compounds containing s 2 , p 6 , d 10, and transition metal ions. Normal values of dispersion (A⫽50– 80 ⫻10⫺16 m2兲 were found in borates, aluminates, gallates, silicates, germanates, phosphates, and sulfates not containing J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 964 TABLE 7. Dispersion parameters for oxides and fluorides s 2 Atom 具A典b ⫺16 具 E o典 c 具 E d典 c Why low 共eV兲 共eV兲 具A典? Mineral 共%兲 As2 O3 arsenolite 40 105 8.9 17.3 Sb3⫹ 5s 2 Sb2 O3 Na2 SbF5 senarmontite 40 12 116 142 6.8 10.2 20.3 11 Te4⫹ 5s 2 TeO2 33 108-103 6.2–6.3 23.0–24.6 I5⫹ 5s 2 HIO3 MIO3 KIO2 F2 25 20 17 111 126–95 104 7.6 7.9–8.8 10.2 19.0 16.0–19.3 15.1 50 43 28 33 20 148 121 109 100 84 5.6 7.2 8.0 9.9 10.0 19.4 18.5 18.5 16.2 19.0 33 26 33 13 38 37 40 44 38 33 33 33 40 31 30 33 23 24 17 12 17 8 132–117 132–125 139 127 126–121 121 112–92 111 107–106 114–125 106 104 102–94 97 101 101–91 96–94 96 93 80 79 62 5.6–5.9 6.3 5.2 8.6 5.6–5.7 6.2 5.1 6.2 6.8 8.0–8.4 7.0 6.5–7.2 5.5–6.0 6.3 6.1 5.7–6.0 8.0 7.6–7.5 8.7 9.7 9.1–9.2 10.0 21.7–22.3 19.8 –20.2 22.1 14.6 22.5–23.1 21.5 28.1 23.2 21.9–22.1 15.9–16.7 21.5 23.5–25.9 27.6 –29.9 26.2 26.1 27.8 –29.3 20.9–21.1 22.2–22.4 19.6 20.5 22.0–22.2 26.0 40 29 35 36 21 10 138 139,160 120 126–115 109–96 93 4.8 5.5, 5.4 5.8 5.2–5.4 6.9–7.6 8.7 23.9 21.1, 18.6 22.9 24.2–25.8 20.8 –22.5 19.6 Compound 3⫹ As 4s 2 Chemical composition Tl⫹ 6s 2 TlCl Tl2 SeO4 Tl2 SO4 TlClO4 Tl2 Cd2 共SO4 兲3 Pb2⫹ 6s 2 PbMoO4 Pb5 Ge3 O11 Pb2 Sc.5Ta1.5O6.5 Pb3 Al2 CaSi10O27•3 H2O Pb5 V2.5As.3O12Cl Pb2 MoO5 PbTiO3 Pb5 As3 O9 Cl Pb5 As3 O12Cl PbF2 PbFCl PbWO4 Pb1-x Lax Ti1-y Zry O3 PbNb4 O11 Pb2 KNb5 O15 PbM.33Nb.67O3 Pb3 P2 O8 Pb5 P3 O12Cl PbHPO4 Pb9 Mg9 Si9 O24共OH兲24 PbSO4 PbB4 O7 Bi3⫹ 6s 2 Bi2 O3 Bi2 Mo3 O12 Bi6 Mo2 O15 Bi12MO20 Bi4 M3 O12 BiB3 O6 M⫽Li,K wulfenite wickenburgite vanadinite finnemanite mimetite matlockite stolzite M⫽Mg,Zn pyromorphite molybdophyllite M⫽Si,Ge,Ti M⫽Si,Ge a 10 m 2 Mg, Si SO4 Atom % ⫽共total ‘‘soft ions’’⫹H2 O兲/共total cations⫹anions兲. Boldfaced values of 具 A 典 are relatively high. c Boldfaced values of 具 E o典 and 具 E d典 are relatively low. a b any of the above ‘‘soft’’ ions. It appears that A depends on the total concentration of ‘‘soft’’ ions where these ions must be in concentrations ⬎10% – 15%. This number seems to depend on the ion, being lower for Fe3⫹ , Co2⫹ , Ti4⫹ , and Bi3⫹ , and higher for Zn2⫹ , Nb5⫹ , Ta5⫹ , Tl⫹ , and Pb2⫹ . In Tables 4 –9 values of 具 A 典 in boldface type are relatively high, whereas boldface values of 具 E o典 and 具 E d典 are relatively low. 3.3.1. Transition Metal Ions Table 4 shows that many of the compounds containing the transition metal ions Fe3⫹ , Co2⫹ , Ni2⫹ , Eu2⫹ , and U4⫹ with A⫽150– 265 have some of the highest dispersion values of all oxides. Fe2 O3 共hematite兲, FeOOH 共lepidocrocite兲, and Fe2 (SO4 ) 3 all have dispersion values greater than 200 ⫻10⫺16 m2 . The high dispersion values in transition metal J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION 965 TABLE 8. Dispersion parameters for H2 O and crystalline hydrates Atom Compound Mineral 共%兲 a 具A典b ⫺16 10 2 m 具 E o典 c 具 E d典 c Why low 共eV兲 共eV兲 具A典? H2 O 共liquid兲 H2 O 共ice兲 H2 O 共ice兲 100 100 100 225 152 146 9.8 12.3 12.6 7.2 8.5 8.7 Na2 HPO4 •12 H2O Na2 HPO4 . 7 H2O Na4 P2 O7 •10 H2O NaH2 PO4 •H2O NaH2 PO4 •2 H2O 63 50 43 14 25 119 105 101 99 96 11.4 12.0 12.1 11.9 12.3 11.7 12.7 13.1 13.6 13.5 MAl共SO4 兲2 •12 H2O MGa共SO4 兲2 •12 H2O MIn共SO4 兲2 •12 H2O M⫽Na,K,Rb,Cs M⫽K,Rb,Cs M⫽Rb,Cs 60 60 60 101–91 91–92 96 12.3–12.6 12.5–12.6 12.2 12.8–13.8 13.9–14.0 13.6 MSiF6 •6 H2O MSiF6 •6 H2O M⫽Mg,Mn,Fe M⫽Cu,Zn 43 43 97–101 89 13.8 –14.3 13.7–14.1 11.5–11.9 12.8–13.1 Cu6 Si6 O18•6 H2O dioptase 17 94 10.0 17.1 MgSO4 •7 H2O BeSO4 •4 H2O CuSO4 •5 H2O LiSO4 •H2O CaSO4 •2 H2O epsomite 54 33 45 14 25 96 95 85 72 70 12.5 12.4 12 13.9 13.3 13.4 13.6 15.7 15.9 17.1 43 90 12.6 14.1 M⫽K,Rb,Cs M⫽K,Rb,Cs M⫽K,Rb,Cs M⫽K,Rb,Cs 31 31 31 31 31 84–89 82–85 79–82 79–82 81 12.3–12.5 12.9–13.1 12.8 –13.0 12.8 –12.9 12.8 14.6–15.3 14.5–15.1 15.1–15.7 15.1–15.8 15.4 borax 93 88 61 12.5 13.1 13.1 13.8 13.9 19.8 M ⫽ Sm,Pr,Nd 35 11 8 32 32 81–82 11.9–12.1 16.3–16.4 pollucite afwillite 13 79 59 12.5 13.1 16.1 20.8 chalcanthite gypsum LiClO4 •3 H2O M2 Cu共SO4 兲2 •6 H2O M2 Mg共SO4 兲2 •6 H2O M2 Zn共SO4 兲2 •6 H2O M2 Fe共SO4 兲2 •6 H2O Cs2 Mn共SO4 兲2 •6 H2O Na2 B4 O5 共OH兲4 •8 H2O KB5 O6 共OH兲4 •2 H2O CaB3 O4 共OH兲3 •H2O M2 共SO4 兲3 •8 H2O CsAlSi2 O6 •2 H2O Ca3 Si2 O6 共OH兲2 •2 H2O colemanite Li Ca Ca low H2 O Ca Atom % ⫽共total ‘‘soft ions’’⫹H2 O兲/共total cations⫹anions兲. Boldfaced values of 具 A 典 are relatively high. c Boldfaced values of 具 E o典 and 具 E d典 are relatively low. a b oxides correlate well with values of the parameter E o(4 – 8 eV) and, in general, low values of the parameter E d . Even with relatively low concentrations 共10%兲 of Fe3⫹ rather high dispersion values result. Note that although there is only 4 at % of Fe in MFe共SO4 ) 2 •12 H2 O and 8% in cornellite, Fe2 (SO4 ) 3 •7 H2 O, the total concentrations of ‘‘soft’’ ions (Fe3⫹ ) and H2 O are 54% and 37%, respectively. Similarly, in MCr共SO4 ) 2 •12 H2 O, both Cr3⫹ and H2 O contribute to the dispersion. It is apparently not necessary for the ions to be linked, e.g., compounds with isolated Fe3⫹ such as Ca3 Fe2 Si3 O12 , Na.87Fe.92Al.05Ti.03Si2 O6 共aegirine兲, and M2 CoSi2 O7 共M⫽Ca, Sr兲 have high dispersion 共A ⫽100– 175兲. Hydrates such as FeSO4 OH•2 H2 O and MFe共SO4 ) 2 •2 H2 O 共M⫽K, Rb, Cs and Tl兲 have higher val- ues of E o 共8 –10 eV兲 but because of low E d 共12–13 eV兲 as for other hydrates 共see below兲 still show high dispersion. 3.3.2. d 10 Ions Table 5 shows the dispersion parameters for compounds containing Cu⫹ , Zn2⫹ , As5⫹ , and I7⫹ . Among the oxides Cu2 O has one of the highest dispersions (A⫽267), apparently because of the exceptionally low energy gap of 3.8 eV. Among the Zn-containing compounds only ZnO (A ⫽159– 185) and ZnWO4 (A⫽82– 86) have high dispersion. ZnO has both low E o and E d (CN⫽IV), whereas ZnWO4 has low E o but a higher E d caused by CN⫽6 for both Zn and W. Note that the high dispersion of ZnWO4 results from the J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 966 TABLE 9. Dispersion parameters associated with ions. N c is the cation coordination number, N e the effective number of valence electrons per anion, and Z a the formal valence of the anion No. of 具A典a 具A典a 具 E o典 具 E o典 b 具 E d典 具 E d典 b Ed Ion compounds 10⫺16 m2 10⫺16 m2 共eV兲 共eV兲 共eV兲 共eV兲 共eV兲 Beta Nc Ne Za d 10 Cu⫹ Zn2⫹ As5⫹ I7⫹ 2 8 4 1 161–267 59–185 81–100 133 mean 214 91 93 133 range 4–6 6 –15 10–11 9 mean 5.0 9.7 10.8 8.8 range 16 15–26 15–20 mean 15.9 21.0 16.0 13.7 predicted 17 17 17 17 .26 .26 .26 .26 2 4 4 4 16 8 8 8 2 2 2 2 s2 As3⫹ Sb3⫹ Te4⫹ I5⫹ Tl⫹ Pb2⫹ Bi3⫹ 1 2 2 4 5 26 9 105–111 95–142 103–119 95–126 84 –148 62–139 93–160 105 129 110 110 112 104 116 9 7–10 6 8 –10 6 –10 6 –10 5–9 8.8 8.5 6.2 8.5 8.1 6.9 6.2 11–20 23–25 15–19 15–16 16 –30 20–24 17.3 15.7 24.0 17.4 18.3 23.1 23.1 14 14 19 18 .26 .26 .26 .26 .26 .26 .26 3? 3? 4? 3? ⬃8 ⬃8 ⬃8 9? 9? 9? 8? 10? 10? 10? 2 2 2 2 2 2 2 Ti4⫹ V5⫹ Cr6⫹ Mo6⫹ W6⫹ Nb5⫹ Ta5⫹ U6⫹ Cs⫹ Ba2⫹ 20 6 3 hydrates 8 5 15 3 3 hydrates 11 16 71–119 109–264 209–244 88 –160 73–104 69–124 73–107 5–10 4–8 7– 8 6–8 7–10 6–8 6–8 6.2 7.5 7.0 7.3 8.3 6.8 7.3 9.8 14.9 10.9 16 –30 15–22 10 19–24 22–27 21–26 23–26 13–14 14 –20 17–22 22.5 19.6 10.1 21.4 24.2 24.6 25.7 13.9 17.8 17.1 25 17 .26 .26 6 4 8 8 2 2 17,25 17,25 25 25 .26 .26 .26 .26 .26 4,6 4,6 6 6 8 8 8 8 2 2 2 2 58 –107 53–116 115 124 227 107 80 99 86 117 82 78 Fe3⫹ Cr3⫹ Co2⫹ Ni2⫹ U4⫹ Eu2⫹ 12 4 hydrates 2 3 fluorides 1 1 114–225 95–105 117 71–198 264 162 159 98 117 115 264 162 4 –11 11–12 8 8 –14 5 6 6.4 11.8 7.6 11.7 4.2 6.5 17–20 14 12 10–16 17.0 13.9 11.8 14.1 14.5 15.1 19 .26 6 6 2 19 13 .26 .26 .26 .26 6 6 8 6 6 6 6 2 1 2 2 1 2 73 225 146–152 59–119 225 149 90.6 10–14 9.8 12.4 12.3 p6 d5 d3 d7 d8 f2 f7 H2 O ice hydrates a 11–20 19 7.2 8.6 14.4 Boldfaced values of 具 A 典 are relatively high. Boldfaced values of 具 E o典 and 具 E d典 are relatively low. b combined presence of Zn2⫹ and W6⫹ . All the other Zncontaining compounds have relatively high oscillator energies and therefore lower dispersion. Arsenates which might be expected to have low dispersion because of their high E o have relatively high dispersion resulting from tetrahedral As5⫹ and low E d . KIO4 , the only example of an iodate, has high dispersion (A⫽133) because of both low E o and E d (CN⫽IV for I7⫹ 兲. 3.3.3. p 6 Ions In Table 6 we list the dispersion parameters for titanates, vanadates, chromates, niobates, tantalates, molybdates, and tungstates. All titanium-bearing compounds with ⬎10% Ti content have high dispersion, and are associated with E o values in the range of 5– 8 eV. Between 12% and 33% Ti there is no obvious concentration dependence. Fresnoite, Ba2 TiSi2 O8 , the one Ti compound with Ti⬍10% has normal dispersion. Similarly all vanadates have high dispersion values with V2 O5 having one of the highest values (A⫽264) and one of lowest values of E o⫽4.1 eV. Values of the vanadate parameter E o are similar to those of the titanates, being in the range 4 – 8 eV. Although chromate dispersions are augmented by the presence of H2 O 共see below兲, we believe because of the exceptionally high values of A, the primary contributor to the high dispersion is the presence of the Cr6⫹ ion. Most niobates and tantalates have high dispersion but the values depend on the concentration with significantly lower dispersion for Ba3 LaNb3 O12 and LaNbO4 , where E o has increased to 8.4 eV. Tantalates, because of slightly higher E o values, have slightly lower dispersion than niobates, e.g., compare LiNbO3 with A⫽91– 88 and LiTaO3 with A⫽81– 79. All reported molybdates have high dispersion. Following the same behavior as niobates and tantalates where the compounds lower in the periodic table have lower dispersion, the tungstates have slightly lower dispersion than the molybdates. Among the uranyl compounds, meta- J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions REFRACTIVE INDEX AND DISPERSION torbernite 关 Cu共UO2 PO4 ) 2 •8 H2 O] and K2 UO2 (SO4 ) 2 •2 H2 O have high dispersion but this high dispersion may arise partially from the presence of water of hydration. -uranophane, Ca(UO2 )(UOOH)SiO4 )(SiO3 OH)•4 H2 O, containing 4 H2 O has, however, normal dispersion. Cs⫹ and Ba2⫹ compounds seem to be conditionally ‘‘soft’’ ions. A few Cs compounds such as CsB3 O5 , CsLiB6 O10 , CsAlSi2 O6 •x H2 O and Cs2 SeO4 , and Ba compounds such as BaO, BaBe2 Si2 O7 , BaAlSi2 O8 , and Ba2 MgGe2 O7 have moderately high dispersion. 3.3.4. s 2 Ions Wemple 共1977兲 noted the reduced average energy gaps E o for the s 2 ions Tl⫹ , Pb2⫹ , and Bi3⫹ . We note in Table 7 that all the lone-pair cations lead to high dispersion. In general E o values are low, varying from 5 to 9 eV. The highest dispersion is observed in TlCl, Na2 SbF5 , PbMoO4 , Pb5 Ge3 O11 , Pb2 Sc0.5Ta1.5O6.5 , Bi2 O3 , and Bi2 Mo3 O12 . As for other compounds, the critical concentration of metal ion or combination of ‘‘soft’’ ions appears to be ⬃10%. Both Tl2 Cd2 (SO4 ) 3 (A⫽84) and PbB4 O7 (A⫽62) with ⬃10% metal ions have reduced dispersion. 3.3.5. H2 O and Hydrates DiDomenico and Wemple 共1969兲 and Wemple 共1977兲 noted the low values of the parameter E d for both liquid H2 O and ice 共9.5 and 8.6 eV, respectively兲. We find a slightly lower value for liquid H2 O of 7.3 eV. Table 8 shows that almost all hydrates have relatively low values of E d , generally in the range 12–16 eV. Exceptions are dioptase (Cu6 Si6 O18•6 H2 O), K 2 UO2 (SO4 ) 2 •2 H2 O, gypsum (CaSO4 •2 H2 O), and afwillite 关 Ca3 Si2 O6 (OH) 2 •2 H2 O兴 . The combination of moderate E o and low E d results in most hydrates having relatively high dispersion. 3.3.6. Summary of Effect of Electron Configuration and E o and E d on Dispersion Table 9 summarizes the mean and maximum dispersion parameters A, E o , and E d along with their range for H2 O, hydrates and compounds containing the d 10 ions Cu⫹ , Zn2⫹ , As5⫹ , and I7⫹ , the s 2 ions As3⫹ , Sb3⫹ , Te4⫹ , I5⫹ , Tl⫹ , Pb2⫹ , and Bi3⫹ , the p 6 ions Ti4⫹ , V5⫹ , Cr6⫹ , Mo6⫹ , Nb5⫹ , and Ta5⫹ , and the transition metal ions, Fe3⫹ , Cr3⫹ , Co2⫹ , Ni2⫹ , U4⫹ , and Eu2⫹ . High dispersion (A ⫽⬃140– 250) is especially noticeable for H2 O and the ions Cu⫹ , Zn2⫹ , I7⫹ , Sb3⫹ , V5⫹ , Cr6⫹ , Fe3⫹ , U4⫹ , and Eu2⫹ and for the compounds having a high concentration of H2 O and these ions: liquid H2 O, ice, CuCl, Cu2 O, ZnO, KIO4 , Na2 SbF5 , V2 O5 , Fe2 O3 , FeOOH, Fe2 (SO4 ) 3 , FeSO4 OH, Y3 Fe5 O12 , UO2 , and  -Eu2 SiO4 . In addition compounds containing combinations of these ions and others 967 associated with slightly lower A values have high dispersion: PbMoO4 , Pb2 MoO5 , Pb2 Sc0.5Ta1.5O6.5 , Pb5 V2.5As.3O12Cl, Bi2 Mo3 O12 , and Bi6 Mo2 O15 . As noted in Sec. 3.3, dispersion is controlled by the combined effects of E o and E d. It is apparent from Fig. 2 that the low E o values associated with these ions go a long way toward explaining the high dispersion values of compounds containing these ions. Note for example the low energy gaps associated with compounds containing Cu⫹ , Te4⫹ , Bi3⫹ , Ti4⫹ , Fe3⫹ , U4⫹ , and Eu2⫹ . However, it is clear that not only is low E o necessary for high dispersion but also E d must be reasonably low. Although the plot of A versus E d shows a poorer fit to 1/E o than 1/E d , the effects of E d can be clearly seen in many cases. The effects of formal valence Z a can be seen in low E d and the relatively high dispersion of CuCl, Na2 SbF5 , TlCl, and NiF2 caused by lowered E d and the effects of cation coordination can be observed in Cu2 O, ZnO, arsenates, vanadates, iodates, molybdates, and the ions As3⫹ , Sb3⫹ , Te4⫹ , and I5⫹ . As we have shown above, all hydrates have a relatively low E d . The effects of water of hydration are apparent in the high dispersion of FeSO4 OH•2 H2 O, Fe2 (SO4 ) 3 •7 H2 O, Cs2 Mg(CrO4 ) 2 •6 H2 O, MgCrO4 •7 H2 O, Pb3 Al2 CaSi10O27•3 H2 O, and Cu(UO2 PO4 ) 2 •8 H2 O. It is tempting to try to complement this rationalization of high dispersion values by correlating observed and calculated values of E d with dispersion. Using the Wemple and DiDomenico 共1971兲 scheme for calculating E d for single ion compounds, it is not possible to calculate E d for most compounds in Table 1 because of uncertainty over what to use for: 共1兲 covalency; 共2兲 N e for s 2 and certain d 10 compounds; and 共3兲 cation coordination when there are two or more cations with differing N c , i.e., YVO4 , CaTiO3 , CaMoO4 , Y3 Fe5 O12 , and more complex compounds such as crystalline hydrates. Indeed, Wemple and DiDomenico noted that the scheelite compounds MMoO4 with M⫽Ca, Sr, and Pb did not fit the scheme with  ⫽0.27. On the other hand Wemple found that ‘‘anion radical’’ groups such as phosphates, sulfates, selenates, and chlorates resulted in good agreement between observed and calculated E d but that a good fit was obtained for the iodates HIO3 and LiIO3 only by using  ⫽0.42– 0.44. We have compared E d values calculated using 5⫺ the properties of the anion groups such as BO3⫺ 3 , BO4 , 3⫺ 3⫺ 2⫺ 2⫺ 2⫺ 2⫺ PO4 , VO4 , SO4 , SeO4 , MoO4 , and WO4 and find that the counter ion almost always has an effect on E d . These uncertainties added to those about N e and N c make it difficult to rely on calculated E d values in the majority of multiion compounds. Thus, we make only the very general observation that the presence of H2 O, halide ions, and cations with low CNs such as Cu⫹ , Zn2⫹ , As3⫹ , As5⫹ , Sb3⫹ , Te4⫹ , I5⫹ , V5⫹ , and Mo6⫹ sometimes contribute to lower E d and therefore higher dispersion. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions SHANNON ET AL. 968 4. Acknowledgments We gratefully acknowledge the use of the libraries at Universities in Bochum, Bremen, Mainz, and Boulder, Colorado for the literature search. We are especially indebted to Th. Armbruster, G. E. Jellison, and G. R. Rossman for critical reviews of the manuscript, to H. Fluck of the Gmelin Institute in Frankfort for the use of their library, E. Tillmanns for obtaining some of the earlier mineralogical references from the University of Vienna and Dr. U. Kalepky for use of the library of the Schott Glaswerke in Mainz. We are also grateful to H. Spetzler and J. Smyth for encouragement and support at CIRES/CU. We thank E. Eggers for the final formatting of the manuscript. Finally, one of us 共R.D.S.兲 is indebted to the Humboldt Foundation for financial support. 5. References Adair, R., L.L. Chase, and S.A. Payne, Phys. Rev. B39, 3337–3350 共1989兲. Anderson, O., Fortschr. Min. 52, 611– 629 共1974兲. Axe, J.D., J. Phys. Chem. Solids 30, 1403–1406 共1969兲. Axe, J.D., J.W. 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Weber 共personal communication, 1995兲. M.J. Weber, CRC Handbook of Laser Science and Technology 共Chemical Rubber Corp., Boca Raton, FL, 1995兲. O. Medenbach 共unpublished data, 2000兲. V. Marinova and M. Veleva, in Thin Film Materials and Devices: Developments in Science and Technology. Proceedings of the 10th International School on Condensed Matter Physics, Varna, Bulgaria, Sept. 1– 4, 1998 共World Scientific, Singapore, 1999兲, pp. 525–528. Ref. 2B: Ref. 2C: Ref. 2D: Ref. 3: Ref. 4: Ref. 5: Ref. Ref. Ref. Ref. Ref. Ref. Ref. Ref. 6: 7: 8: 9: 10A: 10B: 10C: 10D: Ref. 11A: Ref. 11B: Ref. Ref. Ref. Ref. 969 12: 13: 14: 15: 7. Appendix 1. List of Codens CHEMICAL ABSTRACTS SERVICE SOURCE INDEX 1907–1999 共CASSI6 1907–1999兲 A ACELAZ Acta. Electronica ACPHAA Ann. Chim. Phys. AFSLAO Aufschluss AJSCAP Am. J. Science AMMIAY Am. Mineral. ANCHAM Anal. Chem. APHYCC Appl. Phys. v1共1973兲–v25共1981兲 APOPAI Appl. Opt. APPLAB Appl. Phys. Lett. B BJAPAJ Br. J. Appl. Phys. 共1950–1969兲 see J. Phys. D. C CHSCBU Chin. Sci. Bull. CIWPAV Carnegie Institution of Washington Publication CPLEEU Chinese Phys. Lett. CRTEDF Cryst. Res. Technol. 共formerly Krist. Tech. - KRTEAW 1966 –1980兲 F FEROA8 Ferroelectrics H HAMBA6 Hamberger Beitr. Z. Angew. Mineralogie u. Kristallphys. I IEJQA7 INOMAF J JACSAT IEEE J. Quantum Electron. Inorg. Mater. 共Eng. transl.兲 J. Am. Chem. Soc. JACTAW JAPIAU JAPNDE JCDTBI J. Am. Ceram. Soc. J. Appl. Phys. 共formerly Physics 1937–兲 Jpn. J. Appl. Phys., Part 1 共1982–兲 J. Chem. Soc., Dalton Trans. JCOMEL JCPSA6 JCRGAE JJAPA5 JNOMFV JOAOD6 JOBPDE JOAOF8 JOPQAG JOSAAH JPCRBU JPCSAW JPSOAW JRNBAG JSSCBI JSTCAM J. Phys. Condens. Matter J. Chem. Phys. J. Cryst. Growth Jpn. J. Appl. Phys. 共1962–1981兲 J. Nonlinear Opt. Phys. Mater. J. Opt. Soc. Am. A 共1984 –兲 J. Opt. Soc. Am. B 共1989–兲 J. Optics A: Pure Appl. Opt. J. Phys. J. Opt. Soc. Am. 共1917–1983兲 J. Phys. Chem. Ref. Data J. Phys. Chem. Solids J. Phys. C J. Res. Natl. Bur. Stds. 共1934 –兲 J. Solid State Chem. J. Struct. Chem. 共Eng. transl. of Zh. Strukt. Khim兲 J. Phys. Soc. Jpn. JUPSUA K KRTEAW M MNLMBB MRBUAC N NIMAER NJGAAY Krist. Tech. 共1966 –1980兲 now Cryst. Res. Technol. Min. Mag. Mater. Res. Bull. Nucl. Instrum. Methods A Neues Jb. Mineral. Geol. Paläont. Beilageband Abt. A. J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. Reuse of AIP content is subject to the terms at: http://jpcrd.aip.org/about/rights_and_permissions 970 NJGAAY SHANNON ET AL. Neues Jb. Geol. Paläont., Abh. Abt. A. 共1925–1950兲 NJGMA2 Neues Jb. Geol. Paläont., Monatsh. 共1950–兲 NJMIAK Neues Jb. Mineral., Abh. 共1950–兲 NJMMAW Neues Jb. Mineral., Monatsh. 1950– O OMATET Opt. Mater. 共Amsterdam兲 OPACAT Optica Acta. OPCOB8 Opt. Commun. OPLEDP Opt. Lett. OPSUA3 Opt. Spectrosc. P PAOAE1 Pure Appl. Optics PHBCDQ Physica B and C PHRVAO Phys. Rev. v1共1893兲–v132共1963兲 PKOMA3 Phys. Kondens. Mater. v1共1963兲–v16共1973兲 PLRBAQ Phys. Rev. B: Solid State 共1970–1978兲 PMABDJ Philos. Mag. B. PPSAAM Proc. Phys. Soc. London, Sect. A. PPSBAP Proc. Phys. Soc. London, Sect. B. PRBMDO Phys. Rev. B: Condens. Matter 共1978 –兲 PRVAAH Phys. Rev., Sect. A. v133共1964兲–v140共1965兲 PSISDG SPIE Opt. Thin Films Applicat. 共1990兲 共Proc. SPIE兲 PSSABA Phys. Status Solidi A 共1970–兲 PSSBBD Phys. Status Solidi B 共1971–兲 R REKEDA Rev. Laser Engineer. Jpn. 共Reza Kenkyu兲 S SJOTBH Sov. J. Opt. Tech. 共Eng. transl. of Opt.-Mekh. Promysh.兲 SJQEAF Sov. J. Quantum Electron. SMPTA8 Schweiz. Mineral. Petrogr. Mitt. SPHCA6 Sov. Phys. - Crystallogr. 共Eng. transl. of Kristallogr.兲 SPHJAR Sov. Phys. - JETP. SPSSA7 Sov. Phys. - Solid State 共Eng. transl. - Fiz. Tverd. Tela Leningrad兲 SSCOA4 Solid State Commun. T TTMMDZ Tschermaks Min. Petr. Mitt. W WLHPAR Z ZAPHAX ZEKRDZ ZEPYAA ZMGPAS ZPCBAL ZPSBAX Wuli Xuebao⫽Acta Physica Sinica 共Chinese兲 Z. Angewandte Physik Z. Kristallogr. Z. Phys. 共1920–1974兲 Zbl. Mineral. Geol. Paleont., Abt. A Z. Phys. Chem., Abt. B J. Appl. Spectrosc.⫽Zh. Prikladnoi Spektroskopy 8. Appendix 2. Alternative Forms of the Sellmeier Equation The general form of the Sellmeier equation is usually given as n 2 ⫽1⫹ 兺j A j2 2 ⫺ 2j with the wavelength of the incident light, and the wavelengths j with the corresponding constants A j representing the wavelengths of maximum absorption at several absorption bands. The refractive indices used in the current work are sufficiently approximated using a one-term Sellmeier equation with wavelengths far distant from the immediate region of the absorption band at o , thus yielding n 2 ⫽1⫹ A o 2 2 ⫺ 2o . Rearranging this equation gives 2o 1 1 ⫽⫺ 2 2⫹ n ⫺1 A o Ao and finally 1 A ⫽⫺ 2 ⫹B n ⫺1 2 关Eq. 共3a兲兴 with A⫽ 2o /A o and B⫽ 1/A o or 2o ⫽A/B. The constant A o is related to Eq. 共3b兲 by the expression E d ⫽A o•E o . J. Phys. Chem. Ref. Data, Vol. 31, No. 4, 2002 Downloaded 24 Jul 2013 to 200.145.3.28. This article is copyrighted as indicated in the abstract. 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