Element = As
ID | Name | XC approx | XC Func | Ultrasoft? | psp class | Nonlinear Corr. | Relativ. | Semicore | Code |
---|---|---|---|---|---|---|---|---|---|
10 | As.pbe-n-van.UPF | GGA | PBE | Y | Van | Y | N | none | QE |
11 | As.pw91-n-van.UPF | GGA | PW91 | Y | Van | Y | N | none | QE |
12 | As.pz-bhs.UPF | LDA | PZ | N | BHS | N | N | none | QE |
290 | 33as.pspnc | LDA | TP | N | TM | N | N | unknown | Abinit |
398 | 33-As.GGA.fhi | GGA | PBE | N | TM | N | N | none | Abinit |
518 | 33as.5.hgh | LDA | TP | N | HGH | N | N | none | Abinit |
662 | As_HSCV_LDA-1.0.xml | LDA | PZ | N | HSCV | N | N | none | Qbox |
663 | As_HSCV_PBE-1.0.xml | GGA | PBE | N | HSCV | N | N | none | Qbox |
896 | As.psf | LDA | PZ | N | TM | N | N | none | Siesta |
969 | As-gga.psf | GGA | PBE | N | TM | N | N | none | Siesta |
1006 | As.rel-pbe-n-kjpaw.UPF | GGA | PBE | N | PAW | Y | Y | none | QE |
1007 | As.rel-pz-n-kjpaw.UPF | LDA | PZ | N | PAW | Y | Y | none | QE |
1086 | As.pbe-n-kjpaw.UPF | GGA | PBE | N | PAW | Y | N | none | QE |
1087 | As.pz-n-kjpaw.UPF | LDA | PZ | N | PAW | Y | N | none | QE |
14 pseudopotentials found in the Virtual Vault