Element = N
ID | Name | XC approx | XC Func | Ultrasoft? | psp class | Nonlinear Corr. | Relativ. | Semicore | Code |
---|---|---|---|---|---|---|---|---|---|
149 | N.blyp-mt.UPF | GGA | BLYP | N | TM | N | N | none | QE |
150 | N.blyp-van_ak.UPF | GGA | BLYP | Y | Van | N | N | none | QE |
152 | N.bp-van_ak.UPF | GGA | BP | Y | Van | N | N | none | QE |
157 | N.pbe-rrkjus.UPF | GGA | PBE | Y | RRKJ | N | N | none | QE |
158 | N.pbe-van_ak.UPF | GGA | PBE | Y | Van | N | N | none | QE |
159 | N.pbe-van_bm.UPF | GGA | PBE | Y | Van | N | N | none | QE |
160 | N.pw91-van_ak.UPF | GGA | PW91 | Y | Van | N | N | none | QE |
161 | N.pz-rrkjus.UPF | LDA | PZ | Y | RRKJ | N | N | none | QE |
162 | N.pz-van_ak.UPF | LDA | PZ | Y | Van | N | N | none | QE |
163 | N.pz-vbc.UPF | LDA | PZ | N | vBCar | N | N | none | QE |
266 | 7n.pspnc | LDA | TP | N | TM | N | N | unknown | Abinit |
371 | 07-N.GGA.fhi | GGA | PBE | N | TM | N | N | none | Abinit |
460 | 07n.pspgth | LDA | TP | N | GTH | N | N | none | Abinit |
477 | 7n.5.hgh | LDA | TP | N | HGH | N | N | none | Abinit |
608 | N_HSCV_LDA-1.0.xml | LDA | PZ | N | HSCV | N | N | none | Qbox |
609 | N_HSCV_PBE-1.0.xml | GGA | PBE | N | HSCV | N | N | none | Qbox |
801 | n.optgga1.fhi | GGA | PBE | N | BR | N | N | none | Abinit |
869 | N.psf | LDA | PZ | N | TM | N | N | none | Siesta |
942 | N-gga.psf | GGA | PBE | N | TM | N | N | none | Siesta |
1050 | N.rel-pbe-n-kjpaw.UPF | GGA | PBE | N | PAW | Y | Y | none | QE |
1051 | N.rel-pz-n-kjpaw.UPF | LDA | PZ | N | PAW | Y | Y | none | QE |
1124 | N.pbe-n-kjpaw.UPF | GGA | PBE | N | PAW | Y | N | none | QE |
1125 | N.pz-n-kjpaw.UPF | LDA | PZ | N | PAW | Y | N | none | QE |
23 pseudopotentials found in the Virtual Vault