Spin-dependent nonorthogonal generalized Wannier functions and their integration with PAW and Hubbard corrections in linear-scaling DFT.
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| Title: | Spin-dependent nonorthogonal generalized Wannier functions and their integration with PAW and Hubbard corrections in linear-scaling DFT. |
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| Authors: | Escobar Azor, Miguel1,2, O'Regan, David D.3, Safavi, Ali1, Dziedzic, Jacek2,4, Skylaris, Chris-Kriton2, Hine, Nicholas D. M.1 n.d.m.hine@warwick.ac.uk |
| Source: | Journal of Chemical Physics. 5/7/2026, Vol. 164 Issue 17, p1-20. 20p. |
| Database: | Academic Search Ultimate |
| ISSN: | 00219606 |
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| DOI: | 10.1063/5.0323596 |
