Element = Zr
| ID | Name | XC approx | XC Func | Ultrasoft? | psp class | Nonlinear Corr. | Relativ. | Semicore | Code |
|---|---|---|---|---|---|---|---|---|---|
| 257 | Zr.pbe-nsp-van.UPF | GGA | PBE | Y | Van | Y | N | sp | QE |
| 258 | Zr.pw91-nsp-van.UPF | GGA | PW91 | Y | Van | Y | N | sp | QE |
| 259 | Zr.pw91-sp-rrkjus.UPF | GGA | PW91 | Y | RRKJ | N | N | sp | QE |
| 297 | 40zr.pspnc | LDA | TP | N | TM | N | N | unknown | Abinit |
| 405 | 40-Zr.GGA.fhi | GGA | PBE | N | TM | N | N | none | Abinit |
| 528 | 40zr.4.hgh | LDA | TP | N | HGH | N | N | none | Abinit |
| 529 | 40zr.12.hgh | LDA | TP | N | HGH | N | N | sp | Abinit |
| 676 | Zr_HSCV_LDA-1.0.xml | LDA | PZ | N | HSCV | N | N | none | Qbox |
| 677 | Zr_HSCV_PBE-1.0.xml | GGA | PBE | N | HSCV | N | N | none | Qbox |
| 790 | zr.optlda1.fhi | LDA | PZ | N | BR | N | N | none | Abinit |
| 827 | zr.ggaopt1.fhi | GGA | PBE | N | BR | N | N | none | Abinit |
| 973 | Zr-gga.psf | GGA | PBE | N | TM | N | N | none | Siesta |
12 pseudopotentials found in the Virtual Vault