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On the microscopic fluctuations driving the NMR relaxation of quadrupolar ions in water.Collective water dynamics in the first solvation shell drive the NMR relaxation of aqueous quadrupolar cations.Detailed balance, internal consistency, and energy conservation in fragment orbital-based surface hopping.How to calculate charge mobility in molecular materials from surface hopping non-adiabatic molecular dynamics - beyond the hopping/band paradigmQuantum localization and delocalization of charge carriers in organic semiconducting crystals
P50
description
investigador
@es
researcher
@en
wetenschapper
@nl
name
Antoine Carof
@en
Antoine Carof
@nl
type
label
Antoine Carof
@en
Antoine Carof
@nl
prefLabel
Antoine Carof
@en
Antoine Carof
@nl
P31
P496
0000-0003-1896-3094