# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/39c4866b-ffbd-4947-81f5-0758040cbe47/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 Y15TmO24 / C2 (5) / materials id 757001](https://mdr.nims.go.jp/datasets/cfd310cd-d466-42dd-ad84-966befa3d102)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 2 2 3 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 30Y 88.90600000 11.00000000 PAW_PBE Y_sv 25May2007 2Tm 168.93000000 9.00000000 PAW_PBE Tm_3 20Jan2003 48O 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. NPAR = 4vasp-settings/POSCAR-unitcell Y Tm O 1.0 14.8986297499999996 0.0000000000000000 -0.0005303300000000 0.0000000000000000 10.5285476599999992 0.0000000000000000 -7.4475989100000000 0.0000000000000000 7.4421932999999996 Y Tm O 30 2 48Direct 0.9998558800000000 0.9995617400000000 0.7494471700000001 0.0000000000000000 0.2172380400000000 0.0000000000000000 0.7494935600000000 0.0005749500000000 0.7822614800000001 0.2505064400000000 0.0005749500000000 0.2177385200000000 0.2823177900000000 0.7498870700000000 0.5326141000000000 0.7831286000000000 0.7503413500000000 0.0336997500000000 0.0001441200000000 0.9995617400000000 0.2505528300000000 0.5000000000000000 0.7825815600000000 0.5000000000000000 0.0005449400000000 0.5007102700000000 0.2511929300000000 0.5000000000000000 0.2174173300000000 0.0000000000000000 0.4994550600000000 0.0007102700000000 0.7488070700000000 0.2176822100000000 0.2498870700000000 0.4673859000000000 0.7168714000000000 0.2503413500000000 0.9663002500000000 0.2497208100000000 0.9995707100000000 0.7174544500000000 0.7502791900000000 0.9995707100000000 0.2825455500000000 0.4998558800000000 0.4995617400000000 0.7494471700000001 0.5000000000000000 0.7172380400000000 0.0000000000000000 0.2494935600000000 0.5005749500000001 0.7822614800000001 0.7505064400000000 0.5005749500000001 0.2177385200000000 0.7823177900000000 0.2498870700000000 0.5326141000000000 0.2831286000000000 0.2503413500000000 0.0336997500000000 0.5001441200000001 0.4995617400000000 0.2505528300000000 0.0000000000000000 0.2825815600000000 0.5000000000000000 0.5005449399999999 0.0007102700000000 0.2511929300000000 0.0000000000000000 0.7174173300000000 0.0000000000000000 0.9994550600000000 0.5007102700000000 0.7488070700000000 0.7176822100000000 0.7498870700000000 0.4673859000000000 0.2168714000000000 0.7503413500000000 0.9663002500000000 0.7497208100000000 0.4995707100000000 0.7174544500000000 0.2502791900000000 0.4995707100000000 0.2825455500000000 0.0000000000000000 0.7834356900000000 0.5000000000000000 0.5000000000000000 0.2834356900000000 0.5000000000000000 0.6297264300000001 0.8598703400000001 0.7814675900000000 0.6299349200000000 0.6407266300000001 0.9782227800000000 0.6390774200000000 0.4007509900000000 0.7581532300000000 0.1406974000000000 0.0981915900000000 0.2610502200000000 0.3588859000000000 0.9012254400000000 0.4791010100000000 0.8589938500000001 0.5983118100000000 0.9799370100000000 0.3702735700000000 0.8598703400000001 0.2185324100000000 0.3700650800000000 0.6407266300000001 0.0217772200000000 0.4013249000000000 0.3702879300000000 0.0106496800000000 0.4013948400000000 0.8703491500000000 0.7920195500000000 0.4029722000000000 0.1313893900000000 0.2952883800000000 0.4013639300000000 0.6296149400000000 0.5106061399999999 0.5986051600000000 0.8703491500000000 0.2079804500000000 0.5986360700000000 0.6296149400000000 0.4893938600000000 0.5970278000000000 0.1313893900000000 0.7047116200000000 0.5986751000000000 0.3702879300000000 0.9893503200000000 0.6298833200000000 0.1407510200000000 0.2809280000000000 0.6286446200000000 0.3575483600000000 0.4789690800000000 0.1411141000000000 0.4012254400000000 0.5208989900000001 0.6410061499999999 0.0983118100000000 0.0200629900000000 0.3593026000000000 0.5981915900000000 0.7389497800000000 0.8609225800000000 0.9007509900000000 0.2418467700000000 0.3701166800000000 0.1407510200000000 0.7190719999999999 0.3713553800000000 0.3575483600000000 0.5210309200000001 0.1297264300000000 0.3598703400000000 0.7814675900000000 0.1299349200000000 0.1407266300000000 0.9782227800000000 0.1390774200000000 0.9007509900000000 0.7581532300000000 0.6406974000000000 0.5981915900000000 0.2610502200000000 0.8588859000000000 0.4012254400000000 0.4791010100000000 0.3589938500000000 0.0983118100000000 0.9799370100000000 0.8702735699999999 0.3598703400000000 0.2185324100000000 0.8700650800000000 0.1407266300000000 0.0217772200000000 0.9013249000000000 0.8702879299999999 0.0106496800000000 0.9013948400000000 0.3703491500000000 0.7920195500000000 0.9029722000000000 0.6313893900000001 0.2952883800000000 0.9013639300000000 0.1296149400000000 0.5106061399999999 0.0986051600000000 0.3703491500000000 0.2079804500000000 0.0986360700000000 0.1296149400000000 0.4893938600000000 0.0970278000000000 0.6313893900000001 0.7047116200000000 0.0986751000000000 0.8702879299999999 0.9893503200000000 0.1298833200000000 0.6407510199999999 0.2809280000000000 0.1286446200000000 0.8575483600000000 0.4789690800000000 0.6411141000000000 0.9012254400000000 0.5208989900000001 0.1410061500000000 0.5983118100000000 0.0200629900000000 0.8593026000000000 0.0981915900000000 0.7389497800000000 0.3609225800000000 0.4007509900000000 0.2418467700000000 0.8701166800000000 0.6407510199999999 0.7190719999999999 0.8713553800000000 0.8575483600000000 0.5210309200000001vasp-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 3 0.000 0.000 0.000