Tailoring van der Waals dispersion interactions with external electric charges

The description of van der Waals interactions should often account for coupling with pervasive electric fields, but this effect has been omitted in atomistic simulations. Here, the authors develop a model to study the effects of external charge on long-range van der Waals interactions.

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Autores principales:	Andrii Kleshchonok, Alexandre Tkatchenko
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2018
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/2e87eba7e09a467a99b6f918a4c743fd
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spelling	oai:doaj.org-article:2e87eba7e09a467a99b6f918a4c743fd2021-12-02T17:32:29ZTailoring van der Waals dispersion interactions with external electric charges10.1038/s41467-018-05407-x2041-1723https://doaj.org/article/2e87eba7e09a467a99b6f918a4c743fd2018-08-01T00:00:00Zhttps://doi.org/10.1038/s41467-018-05407-xhttps://doaj.org/toc/2041-1723The description of van der Waals interactions should often account for coupling with pervasive electric fields, but this effect has been omitted in atomistic simulations. Here, the authors develop a model to study the effects of external charge on long-range van der Waals interactions.Andrii KleshchonokAlexandre TkatchenkoNature PortfolioarticleScienceQENNature Communications, Vol 9, Iss 1, Pp 1-9 (2018)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Andrii Kleshchonok Alexandre Tkatchenko Tailoring van der Waals dispersion interactions with external electric charges
description	The description of van der Waals interactions should often account for coupling with pervasive electric fields, but this effect has been omitted in atomistic simulations. Here, the authors develop a model to study the effects of external charge on long-range van der Waals interactions.
format	article
author	Andrii Kleshchonok Alexandre Tkatchenko
author_facet	Andrii Kleshchonok Alexandre Tkatchenko
author_sort	Andrii Kleshchonok
title	Tailoring van der Waals dispersion interactions with external electric charges
title_short	Tailoring van der Waals dispersion interactions with external electric charges
title_full	Tailoring van der Waals dispersion interactions with external electric charges
title_fullStr	Tailoring van der Waals dispersion interactions with external electric charges
title_full_unstemmed	Tailoring van der Waals dispersion interactions with external electric charges
title_sort	tailoring van der waals dispersion interactions with external electric charges
publisher	Nature Portfolio
publishDate	2018
url	https://doaj.org/article/2e87eba7e09a467a99b6f918a4c743fd
work_keys_str_mv	AT andriikleshchonok tailoringvanderwaalsdispersioninteractionswithexternalelectriccharges AT alexandretkatchenko tailoringvanderwaalsdispersioninteractionswithexternalelectriccharges
_version_	1718380238071660544

Tailoring van der Waals dispersion interactions with external electric charges

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