Self-Consistency Training for Density-Functional-Theory Hamiltonian Prediction

Fuente: arXiv

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Bibliographic Details
Main Authors:	Zhang, He, Liu, Chang, Wang, Zun, Wei, Xinran, Liu, Siyuan, Zheng, Nanning, Shao, Bin, Liu, Tie-Yan
Format:	Preprint
Published:	2024
Subjects:	Machine Learning Chemical Physics Biomolecules
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2403.09560