# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/5a69e018-837d-40b7-bbf0-faa39b201f30/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 Y6Pb8OF32 / R-3 (148) / materials id 621825](https://mdr.nims.go.jp/datasets/98b5bc13-7975-4f4c-bc28-0ffb405dca55)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 2 2 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 18Y 88.90600000 11.00000000 PAW_PBE Y_sv 25May2007 24Pb 207.20000000 14.00000000 PAW_PBE Pb_d 06Sep2000 3O 16.00000000 6.00000000 PAW_PBE O 08Apr2002 96F 18.99800000 7.00000000 PAW_PBE F 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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0.3697103500000000 0.7195258400000000 0.4709665700000000 0.3697178200000000 0.5536165000000000 0.6302821800000000 0.1012487400000000 0.5536165000000000 0.5472728499999999 0.6228334099999999 0.7103550000000001 0.6666666700000000 0.3333333300000000 0.4758768400000000 0.3819643800000000 0.2452511200000000 0.8332062700000000 0.2577727700000000 0.2139395100000000 0.9563116700000001vasp-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 2 2 1 0.000 0.000 0.000