├── LICENSE ├── README.md ├── Si ├── phonon │ ├── POSCAR.vesta │ ├── POSCAR.xsf │ ├── VESTA_FILES │ │ ├── 0.00 0.00 0.00 │ │ │ ├── 10_(57.70)_.vesta │ │ │ ├── 11_(57.70)_.vesta │ │ │ ├── 12_(57.70)_.vesta │ │ │ ├── 13_(57.70)_.vesta │ │ │ ├── 14_(57.70)_.vesta │ │ │ ├── 15_(57.70)_.vesta │ │ │ ├── 16_(64.19)_.vesta │ │ │ ├── 17_(64.19)_.vesta │ │ │ ├── 18_(64.19)_.vesta │ │ │ ├── 19_(64.19)_.vesta │ │ │ ├── 1_(-0.02)_.vesta │ │ │ ├── 20_(64.19)_.vesta │ │ │ ├── 21_(64.19)_.vesta │ │ │ ├── 22_(72.24)_.vesta │ │ │ ├── 23_(72.24)_.vesta │ │ │ ├── 24_(72.24)_.vesta │ │ │ ├── 2_(-0.02)_.vesta │ │ │ ├── 3_(-0.02)_.vesta │ │ │ ├── 4_(21.63)_.vesta │ │ │ ├── 5_(21.63)_.vesta │ │ │ ├── 6_(21.63)_.vesta │ │ │ ├── 7_(21.63)_.vesta │ │ │ ├── 8_(21.63)_.vesta │ │ │ └── 9_(21.63)_.vesta │ │ └── 0.50 0.50 0.50 │ │ │ ├── 10_(53.43)_.vesta │ │ │ ├── 11_(53.43)_.vesta │ │ │ ├── 12_(53.43)_.vesta │ │ │ ├── 13_(57.42)_.vesta │ │ │ ├── 14_(57.42)_.vesta │ │ │ ├── 15_(57.42)_.vesta │ │ │ ├── 16_(57.42)_.vesta │ │ │ ├── 17_(68.56)_.vesta │ │ │ ├── 18_(68.56)_.vesta │ │ │ ├── 19_(68.56)_.vesta │ │ │ ├── 1_(16.76)_.vesta │ │ │ ├── 20_(68.56)_.vesta │ │ │ ├── 21_(68.56)_.vesta │ │ │ ├── 22_(68.56)_.vesta │ │ │ ├── 23_(68.56)_.vesta │ │ │ ├── 24_(68.56)_.vesta │ │ │ ├── 2_(16.76)_.vesta │ │ │ ├── 3_(16.76)_.vesta │ │ │ ├── 4_(16.76)_.vesta │ │ │ ├── 5_(16.76)_.vesta │ │ │ ├── 6_(16.76)_.vesta │ │ │ ├── 7_(16.76)_.vesta │ │ │ ├── 8_(16.76)_.vesta │ │ │ └── 9_(53.43)_.vesta │ ├── band.conf │ ├── band.yaml │ ├── extract_vectors_phonopy.py │ ├── helpme.txt │ ├── prim_cell.in │ ├── supercell-001 │ │ ├── supercell-001.in │ │ └── supercell-001.out │ └── supercell.in ├── pseudo │ └── Si.pbe-n-kjpaw_psl.0.1.UPF └── scf │ ├── scf.in │ └── scf.out ├── extract_vectors_phonopy.py └── pics └── modes.png /LICENSE: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/AdityaRoy-1996/Phonopy_VESTA/HEAD/LICENSE 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