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Detecting stable adsorbates of (1S)-camphor on Cu(111) with Bayesian optimization

Identifying the atomic structure of organic–inorganic interfaces is challenging with current research tools. Interpreting the structure of complex molecular adsorbates from microscopy images can be difficult, and using atomistic simulations to find the most stable structures is limited to partial ex...

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Detalhes bibliográficos
Publicado no:Beilstein J Nanotechnol
Main Authors: Järvi, Jari, Rinke, Patrick, Todorović, Milica
Formato: Artigo
Idioma:Inglês
Publicado em: Beilstein-Institut 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7590619/
https://ncbi.nlm.nih.gov/pubmed/33134002
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3762/bjnano.11.140
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