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Comparison of polarizabilities for HF/cc-pCVDZ

Units are Å3
Change units.
species name calculated experimental difference
BeH2 beryllium dihydride 2.370 4.340 -1.971
CS2 Carbon disulfide 6.849 8.749 -1.900
Cl2 Chlorine diatomic 2.723 4.610 -1.887
Si2H6 disilane 7.852 9.410 -1.558
H2S Hydrogen sulfide 2.182 3.631 -1.449
CH3Cl Methyl chloride 3.002 4.416 -1.414
CH3SH Methanethiol 3.925 5.186 -1.262
HCl Hydrogen chloride 1.264 2.515 -1.250
C2H4O Ethylene oxide 3.320 4.431 -1.111
N2O Nitrous oxide 1.942 2.998 -1.056
SiH4 Silane 3.764 4.777 -1.013
C2H4 Ethylene 3.182 4.188 -1.006
BF3 Borane, trifluoro- 1.443 2.420 -0.976
PH3 Phosphine 3.362 4.237 -0.874
CH2CCH2 allene 4.816 5.690 -0.874
CO2 Carbon dioxide 1.660 2.507 -0.847
HCN Hydrogen cyanide 1.790 2.593 -0.803
H2O Water 0.727 1.501 -0.774
C2H6 Ethane 3.526 4.226 -0.701
NO Nitric oxide 1.044 1.698 -0.654
CO Carbon monoxide 1.380 1.953 -0.573
O2 Oxygen diatomic 1.002 1.562 -0.560
N2 Nitrogen diatomic 1.202 1.710 -0.509
F2 Fluorine diatomic 0.670 1.160 -0.490
HF Hydrogen fluoride 0.345 0.800 -0.455
Li Lithium atom 24.919 24.330 0.589
Be Beryllium atom 6.541 5.600 0.941
MgO magnesium oxide 10.265 1.750 8.515