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Ab initio study of the ground and excited electronic states of the methyl radical

The ground and some excited electronic states of the methyl radical have been characterized by means of highly correlated ab intio techniques. The specific excited states investigated are those involved in the dissociation of the radical, namely the 3s and 3p(z) Rydberg states, and the A(1) and B(1)...

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Veröffentlicht in:Phys Chem Chem Phys
Hauptverfasser: Zanchet, A., Bañares, L., Senent, M. L., García-Vela, A.
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2016
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5217175/
https://ncbi.nlm.nih.gov/pubmed/27892569
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c6cp05960k
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