Local-MP2 electron correlation method for nonconducting crystals
Rigorous methods for the post-HF (HF-Hartree-Fock) determination of correlation corrections for crystalline solids are currently being developed following different strategies. The CRYSTAL program developed in Torino and Daresbury provides accurate HF solutions for periodic systems in a basis set of...
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Published in | The Journal of chemical physics Vol. 122; no. 9; p. 094113 |
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Main Authors | , , , , , , , |
Format | Journal Article |
Language | English |
Published |
United States
01.03.2005
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Online Access | Get more information |
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