ChIN简介页:MQM++ Program Notes (Rick Muller编写)
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MQM++ Program Notes (Rick Muller编写)

【URL】 http://www.wag.caltech.edu/home/rpm/notes/mqm++/

【简介】
     The current sections cover such topics:Introduction to Quantum Chemistry, Evaluation of Hamiltonian Matrix Elements, Neglect of Differential Overlap (NDO) Techniques, Integrals Between Gaussian Function.

contact

Richard P. Muller
Senior Member of the Technical Staff
Computational Materials and Molecular Biology
Sandia National Laboratories
P.O. Box 5800, MS 0196
Albuquerque, New Mexico 87185-0196
USA

Phone: 505-284-3669
Fax: 505-284-5451
Email: rmuller@sandia.gov


Summary by 何莉 on 2003-12-30

Last updated by 何莉 on 2004-01-02

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