The determination of minima and saddle points on the potential energy surfaces of the hydrogen bonded species 02-HF and 0,-H20 is performed with unrestricted Hartree-Fock calculations. Geometries, electron density distributions, and relative energies for every stationary point are reported. Only one
Electric field dependence of the diabatic potential energy surface for gas-phase electron transfer O2O2− → O2−O2
✍ Scribed by Xiang-Yuan Li; An-Min Tian; Fu-Cheng He; Guo-Sen Yan
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 270 KB
- Volume
- 233
- Category
- Article
- ISSN
- 0009-2614
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