# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/74f16458-11ac-4350-ba09-006be8d3fc92/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 LiZnPO4 / Cc (9) / materials id 555743](https://mdr.nims.go.jp/datasets/e0b037e1-248a-4514-a0db-e4c1c892e0d1)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 1 2 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 32Li 7.01000000 3.00000000 PAW_PBE Li_sv 10Sep2004 32Zn 65.39000000 12.00000000 PAW_PBE Zn 06Sep2000 32P 30.97400000 5.00000000 PAW_PBE P 06Sep2000 128O 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 = 648.744200 EDIFF = 1.000000e-08 EDIFFG = -1.000000e-08 ISMEAR = 0 SIGMA = 1.000000e-02 IALGO = 38 LREAL = .FALSE. ADDGRID = .TRUE. LWAVE = .FALSE. LCHARG = .FALSE. NPAR = 4vasp-settings/POSCAR-unitcell Li Zn P O 1.0 17.2559907800000012 0.0000000000000000 0.0012506700000000 0.0000000000000000 9.7444199800000000 0.0000000000000000 -2.4838763699999999 0.0000000000000000 15.9757784699999998 Li Zn P O 32 32 32 128Direct 0.7265110600000000 0.4134460700000000 0.4989938200000000 0.5064349299999999 0.6937940200000000 0.4973824600000000 0.9201835800000000 0.1600226000000000 0.7468530099999999 0.8860142300000000 0.6826301900000000 0.7472303300000001 0.7564290499999999 0.9455696000000000 0.4968052700000000 0.7564290499999999 0.0544304000000000 0.9968052700000000 0.6392414600000000 0.9367162900000000 0.7472425499999999 0.6392414600000000 0.0632837100000000 0.2472425500000000 0.8860142300000000 0.3173698100000000 0.2472303300000000 0.5064349299999999 0.3062059800000000 0.9973824600000000 0.7265110600000000 0.5865539300000000 0.9989938200000000 0.6675105900000000 0.5933505400000000 0.2486936900000000 0.9201835800000000 0.8399774000000000 0.2468530100000000 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0.1143656200000000 0.8752725900000000 0.4823289100000000 0.3636633900000000 0.8768689700000000 0.9835140500000000 0.2813890600000000 0.2274537800000000 0.0755773400000000vasp-settings/INCAR-force PREC = Accurate GGA = PS IBRION = -1 NELMIN = 5 ENCUT = 648.744200 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 2 1 0.000 0.000 0.000