A new variational single-product approximation to the van der Waals dispersion interaction is presented and discussed. Test computations on atom-atom and diatom-diatom are also presented
G.L. Bendazzoli (2007). Rank-1 approximation to the van der Waals interaction. THEORETICAL CHEMISTRY ACCOUNTS, 118, 135-142 [10.1007/s00214-007-0256-z].
Rank-1 approximation to the van der Waals interaction
BENDAZZOLI, GIAN LUIGI
2007
Abstract
A new variational single-product approximation to the van der Waals dispersion interaction is presented and discussed. Test computations on atom-atom and diatom-diatom are also presentedFile in questo prodotto:
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