Using the MP2 method and basis sets up to near Hartree-Fock limit (NHFL) quality selected to saturate the s, p, d and f shells, we have evaluated the validity of the counterpoise method (CP) as a way of correcting the basis set superposition errors (BSSEs) for hydrogen bonded systems for some of the
✦ LIBER ✦
An application of counterpoise method to a hydrogen bonded system
✍ Scribed by D. Kocjan; J. Koller; A. Ažman
- Publisher
- Elsevier Science
- Year
- 1976
- Tongue
- English
- Weight
- 152 KB
- Volume
- 34
- Category
- Article
- ISSN
- 0022-2860
No coin nor oath required. For personal study only.
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