Germanium
- Plane-wave, pseudopotential (Qbox 1.56.2)
- Germanium HSCV, Ecut=120 Ry.
- xc: LDA
Ge Pseudopotential: Norm-conserving HSCV Ge_HSCV_LDA-1.0.xml
Lattice parameter (fixed): a = 10.68 Bohr = 5.6516 Å
Input file: hscv/gs.i
k-point files: kp12fcc.i, kp_gamma_x_l.i,
Output file: hscv/gs.r
- xc: LDA
- Plane-wave, pseudopotential (Qbox 1.56.2)
- Germanium BHS, Ecut=30 Ry.
- xc: LDA
Ge Pseudopotential: Norm-conserving BHS Ge_BHS_LDA.xml
Lattice parameter (fixed): a = 10.68 Bohr = 5.6516 Å
Input file: bhs/gs.i
k-point files: kp12fcc.i, kp_gamma_x_l.i,
Output file: bhs/gs.r - xc: LDA