Information criteria for quantifying loss of reversibility in parallelized KMC

DOI10.1016/J.JCP.2016.10.031zbMath1406.65005arXiv1605.02375OpenAlexW2356640428WikidataQ57453400 ScholiaQ57453400MaRDI QIDQ1712712

Konstantinos Gourgoulias, Luc Rey-Bellet, Markos A. Katsoulakis

Publication date: 31 January 2019

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1605.02375

zbMATH Keywords

operator splitting schemesentropy productioninformation criteriadetailed balancetime-reversibilitylong-time errorsparallel kinetic Monte Carlo

Mathematics Subject Classification ID

Monte Carlo methods (65C05) Parallel numerical computation (65Y05)

Related Items (1)

Special issue: Predictive multiscale materials modeling

Uses Software

• SPPARKS

Cites Work

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