Accelerating fourth-generation machine learning potentials by quasi-linear scaling particle mesh charge equilibration

Fuente: arXiv

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Bibliographic Details
Main Authors:	Gubler, Moritz, Finkler, Jonas A., Schäfer, Moritz R., Behler, Jörg, Goedecker, Stefan
Format:	Preprint
Published:	2024
Subjects:	Computational Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2403.02155