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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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Detalles Bibliográficos
Autores principales: Järvi, Jari, Rinke, Patrick, Todorović, Milica
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Beilstein-Institut 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7590619/
https://www.ncbi.nlm.nih.gov/pubmed/33134002
http://dx.doi.org/10.3762/bjnano.11.140

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