John A. Keith
University of Pittsburgh
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Articles (11)
Gradient-domain machine learning (GDML) force fields show excellent accuracy, data efficiency, and applicability for molecules, and a many-body approach opens the possibility of increased transferability to molecular ensembles.
Year:
2023
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2023
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2022
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2022
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2022
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2021
Year:
2021
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2021
Year:
2021
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2021
Year:
2021
Collaborators (7)
Alexandre Tkatchenko
-
LUXEMBOURG
Minoru Otani
Professor
University of Tsukuba
JAPAN
Phillip Westmoreland
Professor
North Carolina State University
UNITED STATES
Satoshi Hagiwara
Assistant Professor
University of Tsukuba
JAPAN
Valentin Vassilev-Galindo
Universidad Pública de Navarra (UPNA)
SPAIN
Maureen Tang
Drexel University
UNITED STATES
Guido Falk von Rudorff
Professor Computational Chemistry of Nanomaterials
University of Kassel
GERMANY
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