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A transferable active-learning strategy for reactive molecular force fields. (2021)

First Author: Young TA

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/d1sc01825f

PubMed Identifier: 34476072

Publication URI: http://europepmc.org/abstract/MED/34476072

Type: Journal Article/Review

Volume: 12

Parent Publication: Chemical science

Issue: 32

ISSN: 2041-6520