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Towards Understanding the Decomposition/Isomerism Channels of Stratospheric Bromine Species: Ab Initio and Quantum Topology Study

The present study aims at a fundamental understanding of bonding characteristics of the C–Br and O–Br bonds. The target molecular systems are the isomeric CH(3)OBr/BrCH(2)OH system and their decomposition products. Calculations of geometries and frequencies at different density functional theory (DF...

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Detalles Bibliográficos
Autores principales: Aziz, Saadullah G., Alyoubi, Abdulrahman O., Elroby, Shaaban A., Osman, Osman I., Hilal, Rifaat H.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4424987/
https://www.ncbi.nlm.nih.gov/pubmed/25815595
http://dx.doi.org/10.3390/ijms16046783