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Mechanisms of photoexcitation and photoionization in small water clusters

The mechanisms of photoexcitation and photoionization in small water clusters in gas phase, (H(2)O)(n); n = 2–3, are studied using the complete active-space second-order perturbation theory (CASPT2) with the aug-cc-pVDZ basis set. The present study characterizes for the first time the structures and...

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Detalles Bibliográficos
Autores principales: Suwannakham, Parichart, Chaiwongwattana, Sermsiri, Sagarik, Kritsana
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9089274/
https://www.ncbi.nlm.nih.gov/pubmed/35558945
http://dx.doi.org/10.1039/c8ra06095a