# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/abd3e86d-c793-4605-a418-a5878e78042d/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 Y7DyO12 / I2_12_12_1 (24) / materials id 766292](https://mdr.nims.go.jp/datasets/2c838664-6169-403f-b119-48dd3f592c83)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 2 2 2 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 4Dy 162.50000000 9.00000000 PAW_PBE Dy_3 06Sep2000 28Y 88.90600000 11.00000000 PAW_PBE Y_sv 25May2007 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 Dy Y O 1.0 10.5402730099999999 0.0000000000000000 0.0000000000000000 0.0000000000000000 10.5402711300000007 0.0000000000000000 0.0000000000000000 0.0000000000000000 10.5434843199999992 Dy Y O 4 28 48Direct 0.5000000000000000 0.7500000000000000 0.5328139900000000 0.5000000000000000 0.2500000000000000 0.9671860100000000 0.0000000000000000 0.2500000000000000 0.0328139900000000 0.0000000000000000 0.7500000000000000 0.4671860100000000 0.0000000000000000 0.2500000000000000 0.5326820000000000 0.2500163600000000 0.7499335499999999 0.2499365300000000 0.0327046000000000 0.5000000000000000 0.7500000000000000 0.9672954000000000 0.0000000000000000 0.7500000000000000 0.2500000000000000 0.9673713900000001 0.0000000000000000 0.2500000000000000 0.4672908000000000 0.0000000000000000 0.2500163600000000 0.2500664500000000 0.2500634700000000 0.2499836400000000 0.7499335499999999 0.7500634700000000 0.2499836400000000 0.2500664500000000 0.7499365300000000 0.0000000000000000 0.7500000000000000 0.9673180000000000 0.2500000000000000 0.0326286100000000 0.5000000000000000 0.2500000000000000 0.5327092000000000 0.5000000000000000 0.4673542100000000 0.0000000000000000 0.7500000000000000 0.5326457900000000 0.5000000000000000 0.7500000000000000 0.5000000000000000 0.7500000000000000 0.0326820000000000 0.7500163600000000 0.2499335500000000 0.7499365300000000 0.5327046000000000 0.0000000000000000 0.2500000000000000 0.4672954000000000 0.5000000000000000 0.2500000000000000 0.7500000000000000 0.4673713900000000 0.5000000000000000 0.7500000000000000 0.9672908000000000 0.5000000000000000 0.7500163600000000 0.7500664500000001 0.7500634700000000 0.7499836400000000 0.2499335500000000 0.2500634700000000 0.7499836400000000 0.7500664500000001 0.2499365300000000 0.5000000000000000 0.2500000000000000 0.4673180000000000 0.7500000000000000 0.5326286099999999 0.0000000000000000 0.7500000000000000 0.0327092000000000 0.0000000000000000 0.9673542100000000 0.5000000000000000 0.2500000000000000 0.0326457900000000 0.0000000000000000 0.2500000000000000 0.1514780800000000 0.6202356400000000 0.8907721600000000 0.3485219200000000 0.6202356400000000 0.1092278400000000 0.1202686700000000 0.6091793200000000 0.3485489600000000 0.1202574000000000 0.1092433400000000 0.6514442899999999 0.1202686700000000 0.3908206800000000 0.1514510400000000 0.1202574000000000 0.8907566600000000 0.8485557100000000 0.8485219200000000 0.8797643600000000 0.8907721600000000 0.6514780800000000 0.8797643600000000 0.1092278400000000 0.6093020200000000 0.8484964200000000 0.3796372900000000 0.1092705100000000 0.8485635100000000 0.1202051000000000 0.3907294900000000 0.8485635100000000 0.8797949000000000 0.8906979800000000 0.8484964200000000 0.6203627100000000 0.6092705100000000 0.6514364900000000 0.8797949000000000 0.8907294900000000 0.6514364900000000 0.1202051000000000 0.1093020200000000 0.6515035800000000 0.6203627100000000 0.3906979800000000 0.6515035800000000 0.3796372900000000 0.8486588100000000 0.6203472700000000 0.3906805200000000 0.6513411900000000 0.6203472700000000 0.6093194800000000 0.3797426000000000 0.1092433400000000 0.3485557100000000 0.3797313300000000 0.6091793200000000 0.6514510400000000 0.3797426000000000 0.8907566600000000 0.1514442900000000 0.3797313300000000 0.3908206800000000 0.8485489600000000 0.3486588100000000 0.8796527300000000 0.6093194800000000 0.1513411900000000 0.8796527300000000 0.3906805200000000 0.6514780800000000 0.1202356400000000 0.3907721600000000 0.8485219200000000 0.1202356400000000 0.6092278400000000 0.6202686700000000 0.1091793200000000 0.8485489600000000 0.6202574000000001 0.6092433400000000 0.1514442900000000 0.6202686700000000 0.8908206800000000 0.6514510400000000 0.6202574000000001 0.3907566600000000 0.3485557100000000 0.3485219200000000 0.3797643600000000 0.3907721600000000 0.1514780800000000 0.3797643600000000 0.6092278400000000 0.1093020200000000 0.3484964200000000 0.8796372900000000 0.6092705100000000 0.3485635100000000 0.6202051000000000 0.8907294900000000 0.3485635100000000 0.3797949000000000 0.3906979800000000 0.3484964200000000 0.1203627100000000 0.1092705100000000 0.1514364900000000 0.3797949000000000 0.3907294900000000 0.1514364900000000 0.6202051000000000 0.6093020200000000 0.1515035800000000 0.1203627100000000 0.8906979800000000 0.1515035800000000 0.8796372900000000 0.3486588100000000 0.1203472700000000 0.8906805200000000 0.1513411900000000 0.1203472700000000 0.1093194800000000 0.8797426000000000 0.6092433400000000 0.8485557100000000 0.8797313300000000 0.1091793200000000 0.1514510400000000 0.8797426000000000 0.3907566600000000 0.6514442899999999 0.8797313300000000 0.8908206800000000 0.3485489600000000 0.8486588100000000 0.3796527300000000 0.1093194800000000 0.6513411900000000 0.3796527300000000 0.8906805200000000vasp-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 2 0.000 0.000 0.000