ISSN:
0020-7608
Keywords:
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Source:
Wiley InterScience Backfile Collection 1832-2000
Topics:
Chemistry and Pharmacology
Notes:
Generalized inner projections to dynamic polarizabilities, αA (iω), are shown to give bounds to dispersion coefficients, CAB, which are improved as the dimensionality of the projections is increased. Error bounds in the regular half-planes of αA±(ω) are found from the maximum principle. Comparison with related approximations to polarizabilities is made.
Additional Material:
1 Ill.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560120303
Permalink