Emerging investigator series: first-principles and thermodynamics comparison of compositionally-tuned delafossites: cation release from the (001) surface of complex metal oxides

descriptionPublicationkeyboard_double_arrow_right Article 01 Jan 2020 English Publisher:Royal Society of Chemistry (RSC)Journal:Environmental Science: Nano, volume 7, pages 1,642-1,651 (issn: 2051-8153, eissn: 2051-8161,

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Authors: Joseph W. Bennett; Diamond T. Jones; Blake G. Hudson; Joshua Melendez-Rivera; Robert J. Hamers; Sara E. Mason;

doi: 10.1039/c9en01304k

Emerging investigator series: first-principles and thermodynamics comparison of compositionally-tuned delafossites: cation release from the (001) surface of complex metal oxides

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Abstract

For a set of compositionally tuned complex metal oxides we predict the thermodynamics of aqueous surface transformations that lead to metal release.

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First-Principles and Thermodynamics Comparison of Compositionally-Tuned Delafossites: Cation Release from the (001) Surface of Complex Metal Oxides
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