Effects of local disorder in clay charge distribution on the adsorption and mobility of interlayer and interfacial aqueous species: MD simulations for new models of muscovite and montmorillonite with the CLAYFF force field

Andrey G. Kalinichev; N. Loganathan; Brice F. Ngouana-Wakou

Poster communications

Effects of local disorder in clay charge distribution on the adsorption and mobility of interlayer and interfacial aqueous species: MD simulations for new models of muscovite and montmorillonite with the CLAYFF force field

Andrey G. Kalinichev ^{1, *} N. Loganathan ¹ Brice F. Ngouana-Wakou ¹

* Corresponding author

1 SUBATECH - Radiochimie

SUBATECH - Laboratoire SUBATECH Nantes

Document type :

Poster communications

Domain :

Chemical Sciences / Theoretical and/or physical chemistry

Chemical Sciences / Material chemistry

Sciences of the Universe [physics] / Earth Sciences / Mineralogy

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http://hal.in2p3.fr/in2p3-01577702
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Submitted on : Sunday, August 27, 2017 - 10:09:51 PM
Last modification on : Tuesday, January 11, 2022 - 5:24:02 PM

Effects of local disorder in clay charge distribution on the adsorption and mobility of interlayer and interfacial aqueous species: MD simulations for new models of muscovite and montmorillonite with the CLAYFF force field

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Effects of local disorder in clay charge distribution on the adsorption and mobility of interlayer and interfacial aqueous species: MD simulations for new models of muscovite and montmorillonite with the CLAYFF force field

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