The argon dimer potential energy curve has been investigated using Moller-Plesset perturbation theory through fourth-order (MP4) and the recently developed augmented correlation consistent basis sets for argon. The interaction energy has been determined using the supermolecule approach; trends in bo
A systematic ab initio study of the water dimer in hierarchies of basis sets and correlation models
✍ Scribed by Asger Halkier; Henrik Koch; Poul Jørgensen; Ove Christiansen; Ida M. Beck Nielsen; Trygve Helgaker
- Publisher
- Springer
- Year
- 1997
- Tongue
- English
- Weight
- 381 KB
- Volume
- 97
- Category
- Article
- ISSN
- 1432-2234
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