Element = Pb
ID | Name | XC approx | XC Func | Ultrasoft? | psp class | Nonlinear Corr. | Relativ. | Semicore | Code |
---|---|---|---|---|---|---|---|---|---|
181 | Pb.pbe-d-van.UPF | GGA | PBE | Y | Van | N | N | d | QE |
183 | Pb.pz-bhs.UPF | LDA | PZ | N | vBCar | N | N | none | QE |
184 | Pb.pz-d-van.UPF | LDA | PZ | Y | Van | N | N | d | QE |
337 | 82pb.pspnc | LDA | TP | N | TM | N | N | unknown | Abinit |
442 | 82-Pb.GGA.fhi | GGA | PBE | N | TM | N | N | none | Abinit |
589 | 82pb.4.hgh | LDA | TP | N | HGH | N | N | none | Abinit |
732 | Pb_HSCV_LDA-1.0.xml | LDA | PZ | N | HSCV | N | N | none | Qbox |
733 | Pb_HSCV_PBE-1.0.xml | GGA | PBE | N | HSCV | N | N | none | Qbox |
796 | pb.optlda1.fhi | LDA | PZ | N | BR | N | N | none | Abinit |
861 | pb.optgga1.fhi | GGA | PBE | N | BR | N | N | none | Abinit |
862 | pb.optgga4.fhi | GGA | PBE | N | BR | N | N | none | Abinit |
924 | Pb.psf | LDA | PZ | N | TM | N | N | none | Siesta |
995 | Pb-gga.psf | GGA | PBE | N | TM | N | N | none | Siesta |
1060 | Pb.rel-pbe-dn-kjpaw.UPF | GGA | PBE | N | PAW | Y | Y | d | QE |
1061 | Pb.rel-pz-dn-kjpaw.UPF | LDA | PZ | N | PAW | Y | Y | d | QE |
1133 | Pb.pbe-dn-kjpaw.UPF | GGA | PBE | N | PAW | Y | N | d | QE |
1134 | Pb.pz-dn-kjpaw.UPF | LDA | PZ | N | PAW | Y | N | d | QE |
17 pseudopotentials found in the Virtual Vault