QUANTUM-CHEMICAL CALCULATION OF CORRELATION DIAGRAM STATES IN THE PHOTODISSOCIATION REACTION ClO –-ANION
Potential energy curves of the ground and few excited states of ClO–-anion during destruction reaction, which correlate with lowed dissociation limits are obtained on the base calculations results by ab initio method in the TZV basis. The singlet — triplet nonadiabatic transition with dissociation g...
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Formato: | Artigo |
Idioma: | English |
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Odessa I. I. Mechnikov National University
2015-03-01
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Colecção: | Vìsnik Odesʹkogo Nacìonalʹnogo Unìversitetu: Hìmìâ |
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Acesso em linha: | http://heraldchem.onu.edu.ua/article/view/40105 |