Reducing the Cost of Quantum Chemical Data By Backpropagating Through Density Functional Theory

Fuente: arXiv

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Bibliographic Details
Main Authors:	Mathiasen, Alexander, Helal, Hatem, Balanca, Paul, Krzywaniak, Adam, Parviz, Ali, Hvilshøj, Frederik, Banaszewski, Blazej, Luschi, Carlo, Fitzgibbon, Andrew William
Format:	Preprint
Published:	2024
Subjects:	Machine Learning
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2402.04030