## Abstract We have applied the __ab initio__ formulation of the perturbative configuration interaction using localized orbitals (PCILO) method up to third order to calculate intermolecular and intramolecular interaction energies going beyond the __ab initio__ HartreeβFock calculation. For the rota
Split-valence bond-orbital calculations of intermolecular and intramolecular interactions
β Scribed by Gian Franco Musso; Valerio Magnasco
- Book ID
- 119116808
- Publisher
- Elsevier Science
- Year
- 1987
- Tongue
- English
- Weight
- 623 KB
- Volume
- 152
- Category
- Article
- ISSN
- 0166-1280
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