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Spin-Dependent Nonorthogonal Generalized Wannier Functions and their Integration with PAW and Hubbard Corrections in Linear-Scaling DFT

Fuente: arXiv
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Bibliographic Details
Main Authors: Azor, Miguel Escobar, O'Regan, David D., Safavi, Ali, Dziedzic, Jacek, Skylaris, Chris-Kriton, Hine, Nicholas D. M.
Format: Preprint
Published: 2025
Subjects:
Materials Science
Online Access:
Acceder al recurso
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