Comparison of local‐density and Hartree–Fock calculations of molecular polarizabilities and hyperpolarizabilities-Reference-Cited by-同舟云学术

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Comparison of local‐density and Hartree–Fock calculations of molecular polarizabilities and hyperpolarizabilities

Published:1993-03-15 Issue:6 Volume:98 Page:4753-4765
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Guan Jingang,Duffy Patrick,Carter Jonathan T.,Chong Delano P.,Casida Kim C.,Casida Mark E.,Wrinn Michael

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.464979

Reference59 articles.

1. An all‐electron numerical method for solving the local density functional for polyatomic molecules

2. New algorithm for the optimization of geometries in local density functional theory

3. The density functional formalism, its applications and prospects

4. Time-dependent local-density theory of dielectric effects in small molecules

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