Comparison of polarizabilities for MP2FC/cc-pVTZ
| species |
name |
calculated |
experimental |
difference |
| NaLi |
lithium sodium |
35.864 |
39.999 |
-4.136 |
| NO2 |
Nitrogen dioxide |
0.413 |
2.910 |
-2.497 |
| CH3SCH3 |
Dimethyl sulfide |
6.405 |
7.550 |
-1.145 |
| CH2F2 |
Methane, difluoro- |
2.172 |
3.200 |
-1.028 |
| C6H5F |
Fluorobenzene |
9.208 |
10.200 |
-0.992 |
| H2S |
Hydrogen sulfide |
2.704 |
3.631 |
-0.927 |
| CH3Cl |
Methyl chloride |
3.551 |
4.416 |
-0.865 |
| HCl |
Hydrogen chloride |
1.726 |
2.515 |
-0.789 |
| C2H4 |
Ethylene |
3.462 |
4.188 |
-0.726 |
| Ar |
Argon atom |
0.961 |
1.664 |
-0.703 |
| C2H2 |
Acetylene |
2.789 |
3.487 |
-0.698 |
| CH3OCH3 |
Dimethyl ether |
4.493 |
5.160 |
-0.666 |
| C3H6 |
Cyclopropane |
4.991 |
5.640 |
-0.649 |
| O2 |
Oxygen diatomic |
0.939 |
1.562 |
-0.623 |
| NO |
Nitric oxide |
1.131 |
1.698 |
-0.567 |
| H2CO |
Formaldehyde |
2.226 |
2.770 |
-0.544 |
| CH2CCH2 |
allene |
5.153 |
5.690 |
-0.537 |
| N2O |
Nitrous oxide |
2.463 |
2.998 |
-0.534 |
| C |
Carbon atom |
1.237 |
1.760 |
-0.523 |
| NH3 |
Ammonia |
1.600 |
2.103 |
-0.502 |
| HCOOH |
Formic acid |
2.820 |
3.319 |
-0.500 |
| H2O |
Water |
1.034 |
1.501 |
-0.467 |
| CH3NH2 |
methyl amine |
3.298 |
3.754 |
-0.455 |
| H |
Hydrogen atom |
0.259 |
0.667 |
-0.407 |
| O |
Oxygen atom |
0.395 |
0.802 |
-0.407 |
| CH3F |
Methyl fluoride |
2.159 |
2.540 |
-0.381 |
| N |
Nitrogen atom |
0.722 |
1.100 |
-0.378 |
| CH3OH |
Methyl alcohol |
2.706 |
3.081 |
-0.375 |
| CH3NHCH3 |
Dimethylamine |
5.093 |
5.447 |
-0.355 |
| F |
Fluorine atom |
0.237 |
0.557 |
-0.320 |
| C2H6 |
Ethane |
3.926 |
4.226 |
-0.300 |
| N2 |
Nitrogen diatomic |
1.415 |
1.710 |
-0.295 |
| CH3CHO |
Acetaldehyde |
4.004 |
4.278 |
-0.274 |
| CO2 |
Carbon dioxide |
2.234 |
2.507 |
-0.273 |
| C3H8 |
Propane |
5.656 |
5.921 |
-0.266 |
| CH4 |
Methane |
2.197 |
2.448 |
-0.251 |
| CO |
Carbon monoxide |
1.704 |
1.953 |
-0.249 |
| Ne |
Neon atom |
0.152 |
0.381 |
-0.229 |
| H2 |
Hydrogen diatomic |
0.575 |
0.787 |
-0.213 |
| He |
Helium atom |
0.094 |
0.208 |
-0.114 |
| SO2 |
Sulfur dioxide |
3.235 |
3.219 |
0.016 |
