A new functional for variational calcula
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Krzystof Szalewicz; Bogumil Jeziorski; Hendrik J. Monkhorst; John G. Zabolitzky
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Article
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1982
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Elsevier Science
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English
β 257 KB
Second-order correlation energies for atoms and molecules are calculated wth a novel vm~ond functional that 1s closely related to the one used before but neglects the most rlmc-consuming terms Consequently much Luger basis sets could be used Results for He, Be, Hz and LiH obtained wth an cxphc~tly