Accurate ab initio intermolecular potential energy surface for the quintet state of the O2(3Σ(-)(g))-O2((3)Σ(-)(g)) dimer
10 pages, 5 figures, 3 tables.-- PACS nrs.: 31.15.bw; 34.20.Gj; 33.15.Bh; 33.20.Tp; 31.50.-x; 31.15.A-.
| Authors: | , , , , |
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| Format: | article |
| Publication Date: | 2008 |
| Country: | España |
| Institution: | Consejo Superior de Investigaciones Científicas (CSIC) |
| Repository: | DIGITAL.CSIC. Repositorio Institucional del CSIC |
| OAI Identifier: | oai:digital.csic.es:10261/13380 |
| Online Access: | http://hdl.handle.net/10261/13380 |
| Access Level: | Open access |
| Keyword: | Van der Waals Log-derivative method O2-O2 dimer O2 Molecules Heisenberg exchange Wave-functions [PACS] Coupled-cluster theory [PACS] Intermolecular and atom-molecule potentials and forces [PACS] General molecular conformation and symmetry stereochemistry [PACS] Vibrational analysis (molecular spectra) [PACS] Potential energy surfaces (atoms and molecules) [PACS] Ab initio calculations (atoms and molecules) |
| Summary: | 10 pages, 5 figures, 3 tables.-- PACS nrs.: 31.15.bw; 34.20.Gj; 33.15.Bh; 33.20.Tp; 31.50.-x; 31.15.A-. |
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