Preview

1-Convexhull
- auxiliary
  - KNiF2
    - input files
      - Convexhull-by CALYPSO and VASP
        INCAR
        320 Bytes
        INCAR_1
        318 Bytes
        INCAR_2
        319 Bytes
        INCAR_3
        320 Bytes
        input.dat
        2.1 kB
      - Energy_for_monomers-by VASP
        F
        INCAR
        291 Bytes
        KPOINTS
        66 Bytes
        POSCAR
        512 Bytes
        POTCAR
        202.0 kB
        K
        INCAR
        291 Bytes
        KPOINTS
        81 Bytes
        POSCAR
        402 Bytes
        POTCAR
        221.7 kB
        Ni
        INCAR
        291 Bytes
        KPOINTS
        85 Bytes
        POSCAR
        402 Bytes
        POTCAR
        231.0 kB
  - KPdF2
    - input files
      - Convexhull-by CALYPSO and VASP
        INCAR
        320 Bytes
        INCAR_1
        318 Bytes
        INCAR_2
        319 Bytes
        INCAR_3
        320 Bytes
        input.dat
        2.1 kB
      - Energy_for_monomers-by VASP
        Pd
        INCAR
        291 Bytes
        KPOINTS
        86 Bytes
        POSCAR
        223 Bytes
        POTCAR
        230.3 kB
- data
  - Convexhull_KNiF2.dat
    25.9 kB
  - Convexhull_KPdF2.dat
    27.3 kB