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Prospects and challenges for computer simulations of monolayer-protected metal clusters

Precise knowledge of chemical composition and atomic structure of functional nanosized systems, such as metal clusters stabilized by an organic molecular layer, allows for detailed computational work to investigate structure-property relations. Here, we discuss selected recent examples of computatio...

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Detalhes bibliográficos
Publicado no:Nat Commun
Main Authors: Malola, Sami, Häkkinen, Hannu
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group UK 2021
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8044087/
https://ncbi.nlm.nih.gov/pubmed/33850156
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41467-021-22545-x
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