Articles with "trajectory ensemble" as a keyword



Trajectory Ensemble Methods Provide Single-Molecule Statistics for Quantum Dynamical Systems.

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Published in 2022 at "Journal of chemical theory and computation"

DOI: 10.1021/acs.jctc.1c00477

Abstract: The emergence of experiments capable of probing quantum dynamics at the single-molecule level requires the development of new theoretical tools capable of simulating and analyzing these dynamics beyond an ensemble-averaged description. In this article, we… read more here.

Keywords: single molecule; system; methods provide; ensemble methods ... See more keywords