DFT+U author 2020-08-28 21:17 (updated 2022-01-29 22:13) Comments References in the “DFT+U” folder of the group Zotero library. Tutorials for VASP Calculating linear response U parameter An example NiO GGA+U calculation Calculating linear response U parameters. Tutorials for Quantum-ESPRESSO Calculating linear response and self-consistent U parameters: single site Calculating linear response and self-consistent U parameters: multiple sites Comments Please enable JavaScript to view the comments powered by Disqus. Comments powered by Disqus
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