Copper(II) adsorption on the kaolinite(001) surface: Insights from first-principles calculations and molecular dynamics simulations

Xiang‐Ping Kong; Juan Wang

doi:10.1016/j.apsusc.2016.07.112

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Copper(II) adsorption on the kaolinite(001) surface: Insights from first-principles calculations and molecular dynamics simulations

Xiang‐Ping Kong Juan Wang

Year: 2016 Journal: Applied Surface Science Vol: 389 Pages: 316-323 Publisher: Elsevier BV

DOI: 10.1016/j.apsusc.2016.07.112

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Keywords:

Molecular dynamics Kaolinite Adsorption Copper Materials science Chemical physics Surface (topology) Physical chemistry Computational chemistry Chemistry Metallurgy

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Clay minerals and soil interactions

Physical Sciences → Materials Science → Biomaterials

Iron oxide chemistry and applications

Physical Sciences → Energy → Renewable Energy, Sustainability and the Environment

Minerals Flotation and Separation Techniques

Physical Sciences → Environmental Science → Water Science and Technology

Copper(II) adsorption on the kaolinite(001) surface: Insights from first-principles calculations and molecular dynamics simulations

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