# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/af53ac4b-30d2-47b6-9b6c-a9be28962ea3/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 SiO2 / Cmcm (63) / materials id 560973](https://mdr.nims.go.jp/datasets/f3e12c1a-09d8-46cd-97e1-f103271f8d7e)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 3 1 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 36Si 28.08500000 4.00000000 PAW_PBE Si 05Jan2001 72O 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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0.5000000000000000 0.5000000000000000 0.0000000000000000 0.1740379200000000 0.8083894500000000 0.2500000000000000 0.2473198400000000 0.8144952300000000 0.8389690400000001 0.2473198400000000 0.8144952300000000 0.6610309599999999 0.8259620800000000 0.8083894500000000 0.2500000000000000 0.7500000000000000 0.7500000000000000 0.5000000000000000 0.6782632700000000 0.6149987900000000 0.4982916100000000 0.2500000000000000 0.7500000000000000 0.0000000000000000vasp-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 3 1 1 0.000 0.000 0.000