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October 25, 2025SHILAP Revista de lepidopterologíaOpen Access

TorchSim: an efficient atomistic simulation engine in PyTorch

Orion Cohen Janosh Riebesell Rhys E. A. Goodall Adeesh Kolluru Stefano Falletta Jens Krause Jorge Colindres Gerbrand Ceder Abhijeet S. Gangan

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Abstract

TorchSim: an efficient atomistic simulation engine in PyTorch, Cohen, Orion, Riebesell, Janosh, Goodall, Rhys, Kolluru, Adeesh, Falletta, Stefano, Krause, Joseph, Colindres, Jorge, Ceder, Gerbrand, Gangan, Abhijeet S

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Cohen et al. (2025) studied this question.

synapsesocial.com/papers/69de811d353721b241b0be3a https://doi.org/10.1088/3050-287x/ae1799

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