307 citations · 1k across the 25 of their papers we have counts for
Showing 2013 · cond-mat.mtrl-sciShow all
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cond-mat.mtrl-sci2013★ 23 cited
Towards time-dependent, non-equilibrium charge-transfer force fields: Contact electrification and history-dependent dissociation limits
Wolf B. Dapp, Martin H. Müser
Force fields uniquely assign interatomic forces for a given set of atomic coordinates. The underlying assumption is that electrons are in their quantum-mechanical ground state or i…
cond-mat.mtrl-sci2013★ 25 cited
Redox reactions with empirical potentials: Atomistic battery discharge simulations
Wolf B. Dapp, Martin H. Müser
Batteries are pivotal components in overcoming some of today's greatest technological challenges. Yet to date there is no self-consistent atomistic description of a complete batter…