High-throughput determination of Hubbard U and Hund J values for transition metal oxides via the linear response formalism (2024)

Abstract

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Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1103/physrevmaterials.8.014409

Publication URI: http://dx.doi.org/10.1103/physrevmaterials.8.014409

Type: Journal Article/Review

Parent Publication: Physical Review Materials

Issue: 1

ISSN: 2475-9953