├── .gitignore ├── README.md ├── ti3D_eigen ├── 4band.json ├── 8band.json ├── KPOINTS_min ├── KPOINTS_pl ├── KPOINTS_symmetry ├── LICENSE ├── README.md ├── mnk12.json ├── mnk12.py ├── test_mnk12.py └── ti3d_eigen.py ├── ti3D_gf ├── .gitignore ├── LICENSE └── src │ ├── Makefile │ ├── eigen.f90 │ └── main.f90 ├── vasp_inputs ├── Bi2Se3 │ └── bulk │ │ ├── hex-soc-bands │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR │ │ ├── hex-soc-chg │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR │ │ ├── rhomb-non-soc-bands │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR │ │ ├── rhomb-non-soc-chg │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR │ │ ├── rhomb-soc-bands │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR │ │ └── rhomb-soc-chg │ │ ├── INCAR │ │ ├── KPOINTS │ │ └── POSCAR └── LICENSE └── vasp_scripts ├── 4band.json ├── Bi2Se3_MnBi_poscar.py ├── Bi2Se3_Mn_or_Bi_adsorbed.py ├── GPLv2 ├── MnBiposcar.py ├── TEST_EIGENVAL ├── bi2se3poscar ├── bi2se3poscar_frac ├── bi2se3poscar_surf_relaxed ├── eigenval2foo.py ├── 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