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Comparison of meta-GGAs, DFT+U corrections, and hybrid fu... | ResearchHub
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Comparison of meta-GGAs, DFT+U corrections, and hybrid functionals for polaronic point defects in layered MnO2 , NiO2</mml:...
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Authors
Raj Sah
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Raj Sah
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Michael Zdilla
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John Perdew
Published
November 20, 2024
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Journal
Physical review. B./Physical review. B
Topics
Computer Science
Materials Chemistry
Electronic, Optical And Magnetic Materials
DOI
10.1103/physrevb.110.184114