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Active learning meets metadynamics: automated workflow for reactive machine learning interatomic potentials. (2026)

First Author: Vitartas V

Attributed to: EPCC Tier 2 HPC Service funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/d5dd00261c

PubMed Identifier: 41293129

Publication URI: http://europepmc.org/abstract/MED/41293129

Type: Journal Article/Review

Volume: 5

Parent Publication: Digital discovery

Issue: 1

ISSN: 2635-098X