Methods for rapid evaluation of electron repulsion integrals in large-scale LCGO calculations

Author:

Almlöf Jan Erik

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Cited by 6 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献

1. A tribute to Jan Erik Almlöf;Molecular Physics;2017-06-28

2. Reflections on the MOLECULE integral program (and its developer);Molecular Physics;2017-02-23

3. Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates;The Journal of Chemical Physics;2014-09-14

4. Multipole-based integral estimates for the rigorous description of distance dependence in two-electron integrals;The Journal of Chemical Physics;2005-11-08

5. Perspective on "Principles for a direct SCF approach to LCAO-MO ab initio calculations";Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta);2000-02-09

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