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Quantum chemical ab initio calculations for excited states of F IV

✍ Scribed by K. Hegemann; V. Staemmler; R. Fink


Publisher
Springer
Year
1993
Tongue
English
Weight
926 KB
Volume
27
Category
Article
ISSN
1434-6060

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Excited states and photochemistry of sat
✍ Mark S. Gordon πŸ“‚ Article πŸ“… 1976 πŸ› Elsevier Science 🌐 English βš– 442 KB

Rcccivcd 6 Scptcmber 1976 ST0 4G calculations arc carried out on methane in both tetrahcdrd and l&n-Teller dIstorted Czv and Czv symmctcies. Large incrcascs in Cl1 bond lengths are prcdictcd in al! states, and the r B1 state in Czv symmetry is prcdictcd to dissociate to \* B1 mcthylcne and 'Ai Hz wi