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Sebastian Ehlert, Uwe Huniar, Jinliang Ning
Jan Gerit Brandenburg, Andrea Zen, Dario Alfè
Andrea Zen, Jan Gerit Brandenburg, Angelos Michaelides
L Doná, J G Brandenburg, B Civalleri
Andrea Zen
Angelos Michaelides
Dario Alfè
L Doná
B Civalleri
Sebastian Ehlert
Uwe Huniar
Jinliang Ning
James W Furness
Jianwei Sun

Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry
Published on : Apr 08, 2020

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on : Apr 12, 2019