Liquid water contains the building blocks of diverse ice phases

Molecular understanding of water is challenging due to the structural complexity of liquid water and the large number of ice phases. Here the authors use a machine-learning potential trained on liquid water to demonstrate the structural similarity of liquid water and that of 54 real and hypothetical...

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Autores principales: Bartomeu Monserrat, Jan Gerit Brandenburg, Edgar A. Engel, Bingqing Cheng
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2020
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Acceso en línea:https://doaj.org/article/972577bb275c40969d8a378eaf577273
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spelling oai:doaj.org-article:972577bb275c40969d8a378eaf5772732021-12-02T17:31:56ZLiquid water contains the building blocks of diverse ice phases10.1038/s41467-020-19606-y2041-1723https://doaj.org/article/972577bb275c40969d8a378eaf5772732020-11-01T00:00:00Zhttps://doi.org/10.1038/s41467-020-19606-yhttps://doaj.org/toc/2041-1723Molecular understanding of water is challenging due to the structural complexity of liquid water and the large number of ice phases. Here the authors use a machine-learning potential trained on liquid water to demonstrate the structural similarity of liquid water and that of 54 real and hypothetical ice phases.Bartomeu MonserratJan Gerit BrandenburgEdgar A. EngelBingqing ChengNature PortfolioarticleScienceQENNature Communications, Vol 11, Iss 1, Pp 1-8 (2020)
institution DOAJ
collection DOAJ
language EN
topic Science
Q
spellingShingle Science
Q
Bartomeu Monserrat
Jan Gerit Brandenburg
Edgar A. Engel
Bingqing Cheng
Liquid water contains the building blocks of diverse ice phases
description Molecular understanding of water is challenging due to the structural complexity of liquid water and the large number of ice phases. Here the authors use a machine-learning potential trained on liquid water to demonstrate the structural similarity of liquid water and that of 54 real and hypothetical ice phases.
format article
author Bartomeu Monserrat
Jan Gerit Brandenburg
Edgar A. Engel
Bingqing Cheng
author_facet Bartomeu Monserrat
Jan Gerit Brandenburg
Edgar A. Engel
Bingqing Cheng
author_sort Bartomeu Monserrat
title Liquid water contains the building blocks of diverse ice phases
title_short Liquid water contains the building blocks of diverse ice phases
title_full Liquid water contains the building blocks of diverse ice phases
title_fullStr Liquid water contains the building blocks of diverse ice phases
title_full_unstemmed Liquid water contains the building blocks of diverse ice phases
title_sort liquid water contains the building blocks of diverse ice phases
publisher Nature Portfolio
publishDate 2020
url https://doaj.org/article/972577bb275c40969d8a378eaf577273
work_keys_str_mv AT bartomeumonserrat liquidwatercontainsthebuildingblocksofdiverseicephases
AT jangeritbrandenburg liquidwatercontainsthebuildingblocksofdiverseicephases
AT edgaraengel liquidwatercontainsthebuildingblocksofdiverseicephases
AT bingqingcheng liquidwatercontainsthebuildingblocksofdiverseicephases
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