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Path-integral molecular dynamics with actively-trained and universal machine learning force fields

A.A. Solovykh; N.E. Rybin; I.S. Novikov; A.V. Shapeev
Computer Physics Communications · Vol. 319 · pp. 109902 · 2026
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Bibliographic Information

JournalComputer Physics Communications
PublisherNorth-Holland
Publication Date2026-02-01
Publication Year2026
Volume319
Pages109902
Document TypeJournal Article
eISSN0010-4655
DOI10.1016/j.cpc.2025.109902
SubjectEarth and Planetary Sciences

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NARA Access Coverage1969-07-01~Current
Journal Homepagehttps://www.sciencedirect.com/science/journal/00104655
Publisher PageOpen Publisher Page
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