Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction

It is commonly held that van der Waals wells are inevitable in chemical reactions. Here, the authors show that weak van der Waals forces in the entrance channel of a prototypical complex-forming reaction cause a van der Waals saddle instead, with different dynamical effects from a well at low collis...

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Autores principales:	Zhitao Shen, Haitao Ma, Chunfang Zhang, Mingkai Fu, Yanan Wu, Wensheng Bian, Jianwei Cao
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2017
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/7a1202024ec64cc7bab23b94f574eb8a
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spelling	oai:doaj.org-article:7a1202024ec64cc7bab23b94f574eb8a2021-12-02T14:40:56ZDynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction10.1038/ncomms140942041-1723https://doaj.org/article/7a1202024ec64cc7bab23b94f574eb8a2017-01-01T00:00:00Zhttps://doi.org/10.1038/ncomms14094https://doaj.org/toc/2041-1723It is commonly held that van der Waals wells are inevitable in chemical reactions. Here, the authors show that weak van der Waals forces in the entrance channel of a prototypical complex-forming reaction cause a van der Waals saddle instead, with different dynamical effects from a well at low collision energies.Zhitao ShenHaitao MaChunfang ZhangMingkai FuYanan WuWensheng BianJianwei CaoNature PortfolioarticleScienceQENNature Communications, Vol 8, Iss 1, Pp 1-7 (2017)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Zhitao Shen Haitao Ma Chunfang Zhang Mingkai Fu Yanan Wu Wensheng Bian Jianwei Cao Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
description	It is commonly held that van der Waals wells are inevitable in chemical reactions. Here, the authors show that weak van der Waals forces in the entrance channel of a prototypical complex-forming reaction cause a van der Waals saddle instead, with different dynamical effects from a well at low collision energies.
format	article
author	Zhitao Shen Haitao Ma Chunfang Zhang Mingkai Fu Yanan Wu Wensheng Bian Jianwei Cao
author_facet	Zhitao Shen Haitao Ma Chunfang Zhang Mingkai Fu Yanan Wu Wensheng Bian Jianwei Cao
author_sort	Zhitao Shen
title	Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
title_short	Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
title_full	Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
title_fullStr	Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
title_full_unstemmed	Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction
title_sort	dynamical importance of van der waals saddle and excited potential surface in c(1d)+d2 complex-forming reaction
publisher	Nature Portfolio
publishDate	2017
url	https://doaj.org/article/7a1202024ec64cc7bab23b94f574eb8a
work_keys_str_mv	AT zhitaoshen dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT haitaoma dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT chunfangzhang dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT mingkaifu dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT yananwu dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT wenshengbian dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction AT jianweicao dynamicalimportanceofvanderwaalssaddleandexcitedpotentialsurfaceinc1dd2complexformingreaction
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Dynamical importance of van der Waals saddle and excited potential surface in C(1D)+D2 complex-forming reaction

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