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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Autores principales: Daniil A. Kitchaev, Gerbrand Ceder
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2016
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Acceso en línea:https://doaj.org/article/47cb3add712d4413a42aa2254ccc7564
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