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Spin-dependent nonorthogonal generalized Wannier functions and their integration with PAW and Hubbard corrections in linear-scaling DFT (2026)

First Author: Escobar Azor M
Attributed to:  Supporting research communities with large-scale DFT in the next decade and beyond funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/5.0323596

Publication URI: http://dx.doi.org/10.1063/5.0323596

Type: Journal Article/Review

Parent Publication: The Journal of Chemical Physics

Issue: 17