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Photodissociation of the CH(3)O and CH(3)S radical molecules: An ab initio electronic structure study

The electronic states and the spin-orbit couplings between them involved in the photodissociation process of the radical molecules CH(3)X, CH(3)X → CH(3) + X(X = O, S), taking place after the Ā((2)A(1)) ← X̄((2)E) transition, have been investigated using highly correlated ab initio techniques. A two...

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Bibliographic Details
Published in:Phys Chem Chem Phys
Main Authors: Bouallagui, A., Zanchet, A., Yazidi, O., Jaïdane, N., Bañares, L., Senent, M.L., García-Vela, A.
Format: Artigo
Language:Inglês
Published: 2017
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC5995305/
https://ncbi.nlm.nih.gov/pubmed/29143005
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c7cp06054h
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