# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/1cce33ee-c3da-442c-9099-639f35edad8a/download)
## Creator
[Atsushi Togo](https://orcid.org/0000-0001-8393-9766)
## Rights
Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)
## Other metadata
[Ab-initio phonon calculation for Bi2Te2O7 / Pbcn (60) / materials id 667426](https://mdr.nims.go.jp/datasets/f2b89d98-cf2e-4dae-85d0-0de09a344564)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 1 4 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 32Bi 208.98000000 5.00000000 PAW_PBE Bi 08Apr2002 32Te 127.60000000 6.00000000 PAW_PBE Te 08Apr2002 112O 16.00000000 6.00000000 PAW_PBE O 08Apr2002 vasp-settings/INCAR-relax PREC = Accurate GGA = PS IBRION = 2 NSW = 20 NELMIN = 5 ISIF = 3 ENCUT = 520.000000 EDIFF = 1.000000e-08 EDIFFG = -1.000000e-08 ISMEAR = 0 SIGMA = 1.000000e-02 IALGO = 38 LREAL = .FALSE. ADDGRID = .TRUE. LWAVE = .FALSE. LCHARG = .FALSE. 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0.2496137100000000 0.2788080500000000 0.2429206500000000 0.7326946599999999 0.3145315400000000 0.6352966500000000 0.5251770900000000 0.2264345300000000 0.3560408000000000 0.8909069400000000 0.1763864600000000 0.6366843799999999 0.7520646600000001 0.7323826099999999 0.3833078000000000 0.6090930600000000 0.3236135400000000 0.1366843800000000 0.1378852400000000 0.8613211300000000 0.0809441100000000vasp-settings/INCAR-force PREC = Accurate GGA = PS IBRION = -1 NELMIN = 5 ENCUT = 520.000000 EDIFF = 1.000000e-08 ISMEAR = 0 SIGMA = 1.000000e-02 IALGO = 38 LREAL = .FALSE. ADDGRID = .TRUE. LWAVE = .FALSE. LCHARG = .FALSE. NPAR = 4vasp-settings/KPOINTS-relaxAutomatic mesh0Gamma 1 4 1 0.000 0.000 0.000