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The Blue–Violet Color of Pentamethylbismuth: A Visible Spin‐Orbit Effect

Two‐component relativistic time‐dependent density functional theory calculations with spin‐orbit coupling predict yellow and orange–red absorption for BiPh(5) and BiMe(5), respectively, providing an excellent explanation for their respective violet and blue–violet colors. According to the calculatio...

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Pubblicato in:ChemistryOpen
Autori principali: Conradie, Jeanet, Ghosh, Abhik
Natura: Artigo
Lingua:Inglês
Pubblicazione: John Wiley and Sons Inc. 2016
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC5288750/
https://ncbi.nlm.nih.gov/pubmed/28168144
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/open.201600131
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