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Adri C. T. van Duin

Pennsylvania State University - Department of Mechanical Engineering

United States

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Understanding the Chemistry of Cation Leaching in Illite/Water Interfacial System Using Reactive Molecular Dynamics Simulations and Hydrothermal Experiments

Number of pages: 35 Posted: 25 Sep 2019
Adri C.T. van Duin, Ryan Herz-Thyhsen, Janet C. Dewey, John Kaszuba and Adri C. T. van Duin
Pennsylvania State University - Department of Mechanical Engineering, University of Wyoming - Department of Geology and Geophysics, University of Wyoming - Department of Geology and Geophysics, University of Wyoming - Department of Geology and Geophysics and Pennsylvania State University - Department of Mechanical Engineering
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Abstract:

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molecular dynamics, ReaxFF, Leaching, dissolution, mineral, reaction mechanism, hydrometallurgy, hydrothermal