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Handbook of Computational Quantum Chemistry

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This comprehensive text provides upper-level undergraduates and graduate students with an accessible introduction to the implementation of quantum ideas in molecular modeling, exploring practical applications alongside theoretical explanations. Topics include the Hartree-Fock method; matrix SCF equations; implementation of the closed-shell case; introduction to molecular integrals; and much more. 1998 edition.

Author(s): David B. Cook
Edition: 1st edition
Publisher: Dover Publications
Year: 2005

Language: English
Commentary: 49018
Pages: 383