The PseudoDojo: Training and grading a 85 element optimized norm-conserving pseudopotential table.
Michiel J. van SettenMatteo GiantomassiEric BousquetMatthieu J. VerstraeteDon R. HamannXavier GonzeGian-Marco RignanesePublished in: Comput. Phys. Commun. (2018)