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Structure, Energetics, and Dynamics of Smectite Clay Interlayer Hydration: Molecular Dynamics and Metadynamics Investigation of Na-Hectorite
Journal article   Peer reviewed

Structure, Energetics, and Dynamics of Smectite Clay Interlayer Hydration: Molecular Dynamics and Metadynamics Investigation of Na-Hectorite

CP Morrow, AO Yazaydin, M Krishnan, GM Bowers, AG Kalinichev and RJ Kirkpatrick
JOURNAL OF PHYSICAL CHEMISTRY C, Vol.117(10), pp.5172-5187
14/03/2013
DOI: https://doi.org/10.1021/jp312286g

Abstract

Science & Technology Physical Sciences Technology Chemistry Physical Nanoscience & Nanotechnology Materials Science Multidisciplinary Chemistry Science & Technology - Other Topics Materials Science CHEMISTRY PHYSICAL MATERIALS SCIENCE MULTIDISCIPLINARY NANOSCIENCE & NANOTECHNOLOGY ELASTIC NEUTRON-SCATTERING LAYERED DOUBLE HYDROXIDES MONTE-CARLO-SIMULATION COMPUTER-SIMULATIONS MICROSCOPIC SIMULATION ORGANIC-MATTER SODIUM-MONTMORILLONITE DIELECTRIC-PROPERTIES FLUORHECTORITE CLAY INTERCALATED WATER
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