Element = Hf
ID | Name | XC approx | XC Func | Ultrasoft? | psp class | Nonlinear Corr. | Relativ. | Semicore | Code |
---|---|---|---|---|---|---|---|---|---|
327 | 72hf.pspnc | LDA | TP | N | TM | N | N | unknown | Abinit |
432 | 72-Hf.GGA.fhi | GGA | PBE | N | TM | N | N | none | Abinit |
572 | 72hf.12.hgh | LDA | TP | N | HGH | N | N | sp | Abinit |
712 | Hf_HSCV_LDA-1.1.xml | LDA | PZ | N | HSCV | N | N | none | Qbox |
713 | Hf_HSCV_PBE-1.1.xml | GGA | PBE | N | HSCV | N | N | none | Qbox |
847 | hf.optgga1.fhi | GGA | PBE | N | BR | N | N | none | Abinit |
915 | Hf.psf | LDA | PZ | N | TM | N | N | none | Siesta |
987 | Hf-gga.psf | GGA | PBE | N | TM | N | N | none | Siesta |
1036 | Hf.rel-pbe-spn-kjpaw.UPF | GGA | PBE | N | PAW | Y | Y | sp | QE |
1037 | Hf.rel-pz-spn-kjpaw.UPF | LDA | PZ | N | PAW | Y | Y | sp | QE |
1110 | Hf.pbe-spn-kjpaw.UPF | GGA | PBE | N | PAW | Y | N | sp | QE |
1111 | Hf.pz-spn-kjpaw.UPF | LDA | PZ | N | PAW | Y | N | sp | QE |
12 pseudopotentials found in the Virtual Vault