Bridging molecular and continuous descriptions: the case of dynamics in clays

by Jean-François Dufrêche, Benjamin Rotenberg, Virginie Marry, Pierre Turq
Published 2010-03-01

Classical Polarizable Force Field to Study Hydrated Hectorite: Optimization on DFT Calculations and Validation against XRD Data

by Ragnhild Hånde, Vivien Ramothe, Stéphane Tesson, Baptiste Dazas, Eric Ferrage, Bruno Lanson, Mathieu Salanne, Benjamin Rotenberg, Virginie Marry
Published 2018-05-01

How do Nucleotides Adsorb Onto Clays?

by Ulysse Pedreira-Segade, Jihua Hao, Angelina Razafitianamaharavo, Manuel Pelletier, Virginie Marry, Sébastien Le Crom, Laurent J. Michot, Isabelle Daniel
Published 2018-11-01