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The Journal of Chemical Physics|May 8, 2025
Learning mappings between equilibrium states of liquid systems using normalizing flowsAlessandro Coretti, Sebastian Falkner, Phillip L Geissler, et al.
Physical Review Letters|April 5, 2024
Enhanced Sampling of Configuration and Path Space in a Generalized Ensemble by Shooting Point ExchangeSebastian Falkner, Alessandro Coretti, Christoph Dellago
The Journal of Chemical Physics|July 15, 2025
Revisiting shooting point Monte Carlo methods for transition path samplingSebastian Falkner, Alessandro Coretti, Baron Peters, et al.
The Journal of Chemical Physics|November 26, 2008
Precision shooting: Sampling long transition pathwaysMichael Grünwald, Christoph Dellago, Phillip L Geissler
The Journal of Chemical Physics|October 2, 2021
The microscopic mechanism of bulk melting of iceClemens Moritz, Phillip L Geissler, Christoph Dellago
The Journal of Chemical Physics|October 24, 2007
An efficient transition path sampling algorithm for nanoparticles under pressureMichael Grünwald, Christoph Dellago, Phillip L Geissler
The Journal of Physical Chemistry. B|July 21, 2006
Biased sampling of nonequilibrium trajectories: can fast switching simulations outperform conventional free energy calculation methods?Harald Oberhofer, Christoph Dellago, Phillip L Geissler
Proceedings of the National Academy of Sciences of the United States of America|December 22, 2021
Elastic forces drive nonequilibrium pattern formation in a model of nanocrystal ion exchangeLayne B Frechette, Christoph Dellago, Phillip L Geissler
Physical Review Letters|November 8, 2019
Consequences of Lattice Mismatch for Phase Equilibrium in Heterostructured SolidsLayne B Frechette, Christoph Dellago, Phillip L Geissler
The Journal of Chemical Physics|February 8, 2006
Equilibrium free energies from fast-switching trajectories with large time stepsWolfgang Lechner, Harald Oberhofer, Christoph Dellago, et al.
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