## 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
Basis set superposition errors for Slater vs. gaussian basis functions in H-bond interactions
β Scribed by Giuliano Alagona; Caterina Ghio
- Book ID
- 113258165
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 566 KB
- Volume
- 330
- Category
- Article
- ISSN
- 0166-1280
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