Pseudopotential File |
Test files |
Ru.pbe-n-van.UPF
Pseudopotential type: ULTRASOFT Method: Vanderbilt ultrasoft Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr Nonlinear core correction scalar relativistic Origin: Original QE PP library Generated by Vanderbilt code version 7.3.5 More Information: Ru.pbe-n-van.txt Uploaded by Erica Vidal Classification controlled by Paolo Giannozzi | |
Ru.pw91-n-van.UPF
Pseudopotential type: ULTRASOFT Method: Vanderbilt ultrasoft Functional type: Perdew-Wang 91 gradient-corrected functional Nonlinear core correction scalar relativistic Origin: Original QE PP library Generated by Vanderbilt code version 7.3.5 More Information: Ru.pw91-n-van.txt Uploaded by Erica Vidal Classification controlled by Paolo Giannozzi |