# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/4613907f-ec75-4f8d-9f94-3c3337971986/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 Si19Te8 / R3c (161) / materials id 31135](https://mdr.nims.go.jp/datasets/f2f63226-1b0e-4949-ba72-d5f39d6542b2)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 2 2 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 114Si 28.08500000 4.00000000 PAW_PBE Si 05Jan2001 48Te 127.60000000 6.00000000 PAW_PBE Te 08Apr2002 vasp-settings/INCAR-relax PREC = Accurate GGA = PS IBRION = 2 NSW = 20 NELMIN = 5 ISIF = 3 ENCUT = 318.948500 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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0.9352175800000000 0.6592261900000000 0.0756397900000000 0.5860726800000000 0.9243602100000000 0.5835864100000000 0.5860726800000000 0.4164135900000000 0.3407738100000000 0.5860726800000000 0.9925595300000000 0.2502530700000000 0.7527393500000000 0.7497469299999999 0.7423064500000001 0.7527393500000000 0.2576935500000000 0.0074404700000000 0.7527393500000000 0.6666666700000000 0.3333333300000000 0.0224190300000000 0.6666666700000000 0.3333333300000000 0.5224190300000000 0.6666666700000000 0.3333333300000000 0.8346427500000000 0.6666666700000000 0.3333333300000000 0.3346427500000000vasp-settings/INCAR-force PREC = Accurate GGA = PS IBRION = -1 NELMIN = 5 ENCUT = 318.948500 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