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Exploring canyons in glassy energy landscapes using metadynamics

The complex physics of glass-forming systems is controlled by the structure of the low-energy portions of their potential energy landscapes. Here we report that a modified metadynamics algorithm efficiently explores and samples low-energy regions of such high-dimensional landscapes. In the energy la...

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Detalles Bibliográficos
Autores principales: Thirumalaiswamy, Amruthesh, Riggleman, Robert A., Crocker, John C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: National Academy of Sciences 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9618120/
https://www.ncbi.nlm.nih.gov/pubmed/36256806
http://dx.doi.org/10.1073/pnas.2210535119