A metadynamics-based approach to sampling crystallisation events

DOI10.1080/08927020802647280MaRDI QIDQ3394246zbMATH OpenOpenAlexWikidataFDO

Authors D. Quigley, P. M. Rodger

Publication date 28 August 2009

Published in Molecular Simulation (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1080/08927020802647280

zbMATH Keywords

crystallisationfreezingiceLennard-Joneslong timescale

Mathematics Subject Classification ID

Phase transitions (general) in equilibrium statistical mechanics (82B26)

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Cites work

• Adaptive umbrella sampling: Self-consistent determination of the non- Boltzmann bias
• DL_POLY: Application to molecular simulation

Cited in

(1)

• Flux tempered metadynamics

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