New pseudospectral algorithms for electronic structure calculations: Length scale separation and analytical two‐electron integral corrections-Reference-Cited by-同舟云学术

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New pseudospectral algorithms for electronic structure calculations: Length scale separation and analytical two‐electron integral corrections

Published:1994-09 Issue:5 Volume:101 Page:4028-4041
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Greeley Burnham H.,Russo Thomas V.,Mainz Daniel T.,Friesner Richard A.,Langlois Jean‐Marc,Goddard William A.,Donnelly Robert E.,Ringnalda Murco N.

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.467520

Reference29 articles.

1. Solution of self-consistent field electronic structure equations by a pseudospectral method

2. Solution of the Hartree–Fock equations by a pseudospectral method: Application to diatomic molecules

3. Solution of the Hartree–Fock equations for polyatomic molecules by a pseudospectral method

4. Pseudospectral Hartree–Fock calculations on glycine

5. Pseudospectral Hartree–Fock theory: Applications and algorithmic improvements

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