The ground state potential energy surface for the C2H,...S02 complex has been extensively investigated at the Hartree-Fock (HF) level of theory employing the 6-3 1 G\*\* basis set. Electron correlation effects were assessed by second-order Moller-Plesset perturbation theory in single point calculati
An ab initio study of the hydrogen chloride dimer: The potential energy surface and the characterization of the stationary points
โ Scribed by Alfred Karpfen; P.R. Bunker; Per Jensen
- Publisher
- Elsevier Science
- Year
- 1991
- Tongue
- English
- Weight
- 967 KB
- Volume
- 149
- Category
- Article
- ISSN
- 0301-0104
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