Comparison of polarizabilities for
()
Units are Å3
No experimental value is available. Calculated isotropic polarizabilites are listed.
The isotropic polarizability is defined as
the average of the diagonal terms of the polarizability tensor.
Isotropic polarizabilities in Å3
Methods with predefined basis sets
Isotropic polarizabilities in Å3
For descriptions of the methods (AM1, HF, MP2, ...) and basis sets (3-21G, 3-21G*, 6-31G, ...) see the
glossary in section I.C.
Predefined means the basis set used is determined by the method.
