Stochastic symplectic reduced-order modeling for model-form uncertainty quantification in molecular dynamics simulations in various statistical ensembles
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Publication:6609831
DOI10.1016/j.cma.2024.117323MaRDI QIDQ6609831
Rémi Dingreville, S. Kounouho, J. Guilleminot
Publication date: 24 September 2024
Published in: Computer Methods in Applied Mechanics and Engineering (Search for Journal in Brave)
Hamilton's equations (70H05) Numerical methods for Hamiltonian systems including symplectic integrators (65P10) Stochastic particle methods (65C35)
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