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.
發表於2024-12-01
Handbook of Computational Quantum Chemistry 2024 pdf epub mobi 電子書 下載
圖書標籤: 化學 量子化學 計算化學 handbook
Handbook of Computational Quantum Chemistry 2024 pdf epub mobi 電子書 下載