# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/55a3f4a2-2f67-4a2e-ba60-03b259c482ca/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 KEr(PO3)4 / C222_1 (20) / materials id 554615](https://mdr.nims.go.jp/datasets/664b184f-0a22-4240-b5d3-e15456b1c6a9)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 2 2 1 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 8K 39.09800000 7.00000000 PAW_PBE K_pv 17Jan2003 8Er 167.26000000 9.00000000 PAW_PBE Er_3 06Sep2000 32P 30.97400000 5.00000000 PAW_PBE P 06Sep2000 96O 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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0.7592830600000000 0.9421659300000000 0.1572136400000000 0.7917055500000000 0.2296653400000000 0.0866729900000000 0.7722750100000000 0.4732286100000000 0.0470952900000000 0.4055485300000000 0.9737471200000000 0.0470952900000000 0.5944514700000000 0.0262528800000000 0.2507046800000000 0.4930891600000000 0.7754076800000000 0.7492953200000000 0.5069108400000000 0.2754076800000000 0.1392032600000000 0.7645243300000000 0.0879790900000000 0.2266360100000000 0.5383493400000000 0.9315232900000000 0.8607967400000001 0.2354756700000000 0.5879790899999999vasp-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