Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite

Polymorph selection by synthesis conditions is common, important and mechanistically undercharacterized. Here authors show viaab initio calculations that surface energy effects on nucleation rate can explain how solution pH selects dominant forms of FeS2during hydrothermal synthesis.

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Detalles Bibliográficos
Autores principales:	Daniil A. Kitchaev, Gerbrand Ceder
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2016
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/47cb3add712d4413a42aa2254ccc7564
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spelling	oai:doaj.org-article:47cb3add712d4413a42aa2254ccc75642021-12-02T16:50:14ZEvaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite10.1038/ncomms137992041-1723https://doaj.org/article/47cb3add712d4413a42aa2254ccc75642016-12-01T00:00:00Zhttps://doi.org/10.1038/ncomms13799https://doaj.org/toc/2041-1723Polymorph selection by synthesis conditions is common, important and mechanistically undercharacterized. Here authors show viaab initio calculations that surface energy effects on nucleation rate can explain how solution pH selects dominant forms of FeS2during hydrothermal synthesis.Daniil A. KitchaevGerbrand CederNature PortfolioarticleScienceQENNature Communications, Vol 7, Iss 1, Pp 1-7 (2016)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Daniil A. Kitchaev Gerbrand Ceder Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
description	Polymorph selection by synthesis conditions is common, important and mechanistically undercharacterized. Here authors show viaab initio calculations that surface energy effects on nucleation rate can explain how solution pH selects dominant forms of FeS2during hydrothermal synthesis.
format	article
author	Daniil A. Kitchaev Gerbrand Ceder
author_facet	Daniil A. Kitchaev Gerbrand Ceder
author_sort	Daniil A. Kitchaev
title	Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
title_short	Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
title_full	Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
title_fullStr	Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
title_full_unstemmed	Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
title_sort	evaluating structure selection in the hydrothermal growth of fes2 pyrite and marcasite
publisher	Nature Portfolio
publishDate	2016
url	https://doaj.org/article/47cb3add712d4413a42aa2254ccc7564
work_keys_str_mv	AT daniilakitchaev evaluatingstructureselectioninthehydrothermalgrowthoffes2pyriteandmarcasite AT gerbrandceder evaluatingstructureselectioninthehydrothermalgrowthoffes2pyriteandmarcasite
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Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite

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