A systematic determination of hubbard U using the GBRV ultrasoft pseudopotential set
Bennett, Joseph W., Hudson, Blake G., Metz, Irene K., Liang, Dongyue, Spurgeon, Sidney, Cui, Qiang, Mason, Sara E.Volume:
170
Langue:
english
Journal:
Computational Materials Science
DOI:
10.1016/j.commatsci.2019.109137
Date:
December, 2019
Fichier:
PDF, 920 KB
english, 2019