The effect of diffuse functions on minim
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Giuliano Alagona; Caterina Ghio
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Article
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1990
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John Wiley and Sons
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English
β 1003 KB
## Abstract The effect of the addition of diffuse functions of __sp__ type on the first row atoms (and/or of __d__ type on phosphorus) to a MINIβ1 minimal basis set is evaluated by comparing the SCF description of the interaction energy and its decomposition, counterpoise (CP) corrected and uncorre