Applying Space-Group Symmetry to Speed up Hybrid-Functional Calculations within the Framework of Numerical Atomic Orbitals

Fuente: arXiv

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Bibliographic Details
Main Authors:	Cao, Yu, Zhang, Min-Ye, Lin, Peize, Chen, Mohan, Ren, Xinguo
Format:	Preprint
Published:	2025
Subjects:	Computational Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2504.02422