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Digital quantum simulation of molecular vibrations

Molecular vibrations underpin important phenomena such as spectral properties, energy transfer, and molecular bonding. However, obtaining a detailed understanding of the vibrational structure of even small molecules is computationally expensive. While several algorithms exist for efficiently solving...

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Detalhes bibliográficos
Publicado no:Chem Sci
Main Authors: McArdle, Sam, Mayorov, Alexander, Shan, Xiao, Benjamin, Simon, Yuan, Xiao
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6568047/
https://ncbi.nlm.nih.gov/pubmed/31293758
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c9sc01313j
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