# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/8607a657-714f-46df-8b42-7551f5ed0df6/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 In(IO3)3 / R-3 (148) / materials id 23559](https://mdr.nims.go.jp/datasets/7221ac19-3466-42d2-a962-405a1e4cc64c)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "R-3"  number: 148  Hall_symbol: "-R 3"primitive_matrix:- [  0.666666666666667, -0.333333333333333, -0.333333333333333 ]- [  0.333333333333333,  0.333333333333333, -0.666666666666667 ]- [  0.333333333333333,  0.333333333333333,  0.333333333333333 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     4.828651216666672,     2.787823083333330,     4.761941549999995 ] # a  - [    -4.828651223333329,     2.787823073333330,     4.761941549999995 ] # b  - [     0.000000006666671,    -5.575646156666669,     4.761941549999995 ] # c  points:  - symbol: O  # 1    coordinates: [  0.271937090000000,  0.781571290000001,  0.577544230000000 ]    mass: 15.999400  - symbol: O  # 2    coordinates: [  0.577544230000000,  0.271937090000001,  0.781571290000000 ]    mass: 15.999400  - symbol: O  # 3    coordinates: [  0.781571290000000,  0.577544230000001,  0.271937090000000 ]    mass: 15.999400  - symbol: O  # 4    coordinates: [  0.728062910000000,  0.218428700000000,  0.422455770000000 ]    mass: 15.999400  - symbol: O  # 5    coordinates: [  0.422455770000000,  0.728062900000000,  0.218428710000000 ]    mass: 15.999400  - symbol: O  # 6    coordinates: [  0.218428710000000,  0.422455760000000,  0.728062910000000 ]    mass: 15.999400  - symbol: O  # 7    coordinates: [  0.916210460000000,  0.690941370000001,  0.573961670000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.573961670000000,  0.916210470000001,  0.690941360000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.065408260000000,  0.705418550000001,  0.951236470000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.705418550000000,  0.951236470000001,  0.065408260000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.951236470000000,  0.065408260000001,  0.705418550000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.934591740000000,  0.294581440000000,  0.048763530000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.294581440000000,  0.048763530000000,  0.934591740000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.048763530000000,  0.934591740000000,  0.294581440000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.309058650000000,  0.426038330000003,  0.083789540000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.426038330000000,  0.083789540000003,  0.309058650000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.083789540000000,  0.309058650000003,  0.426038330000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.690941360000000,  0.573961680000001,  0.916210460000000 ]    mass: 15.999400  - symbol: In # 19    coordinates: [  0.822482430000000,  0.822482440000001,  0.822482430000000 ]    mass: 114.818000  - symbol: In # 20    coordinates: [  0.177517570000000,  0.177517580000003,  0.177517570000000 ]    mass: 114.818000  - symbol: I  # 21    coordinates: [  0.710282840000000,  0.413436030000000,  0.132139010000000 ]    mass: 126.904470  - symbol: I  # 22    coordinates: [  0.867860980000000,  0.289717150000001,  0.586563980000000 ]    mass: 126.904470  - symbol: I  # 23    coordinates: [  0.586563980000000,  0.867860970000001,  0.289717160000000 ]    mass: 126.904470  - symbol: I  # 24    coordinates: [  0.289717160000000,  0.586563970000001,  0.867860980000000 ]    mass: 126.904470  - symbol: I  # 25    coordinates: [  0.413436020000000,  0.132139020000000,  0.710282840000000 ]    mass: 126.904470  - symbol: I  # 26    coordinates: [  0.132139010000000,  0.710282850000000,  0.413436020000000 ]    mass: 126.904470  reciprocal_lattice: # without 2pi  - [     0.103548584671038,     0.059783803465559,     0.069999459219178 ] # a*  - [    -0.103548584794849,     0.059783803217938,     0.069999459219178 ] # b*  - [     0.000000000123811,    -0.119567606683496,     0.069999459219178 ] # c*unit_cell:  lattice:  - [     9.657302440000000,     0.000000010000000,     0.000000000000000 ] # a  - [    -4.828651230000000,     8.363469230000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    14.285824650000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.061586220000000,  0.632806640000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.367193360000000,  0.428779580000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.571220420000000,  0.938413780000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.605080450000000,  0.700526690000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.299473310000000,  0.904553750000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.095446250000000,  0.394919550000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.522505960000000,  0.819742830000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.180257170000000,  0.702763140000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.824720500000000,  0.289451290000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.464730790000000,  0.175279500000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.710548710000000,  0.535269210000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.841946170000000,  0.043882040000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.201935870000000,  0.158053830000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.956117960000000,  0.798064130000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.369429810000000,  0.855839300000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.486409490000000,  0.630570190000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.144160700000000,  0.513590510000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.297236860000000,  0.477494040000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.728252890000000,  0.966139970000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 20    coordinates: [  0.033860030000000,  0.762112920000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 21    coordinates: [  0.237887080000000,  0.271747110000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 22    coordinates: [  0.271747110000000,  0.033860030000000,  0.456315800000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 23    coordinates: [  0.966139970000000,  0.237887080000000,  0.456315800000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 24    coordinates: [  0.762112920000000,  0.728252890000000,  0.456315800000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 25    coordinates: [  0.189172630000000,  0.153076160000000,  0.727037830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 26    coordinates: [  0.846923840000000,  0.036096470000000,  0.727037830000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 27    coordinates: [  0.491387160000000,  0.622784620000000,  0.574021100000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 28    coordinates: [  0.131397460000000,  0.508612840000000,  0.574021100000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 29    coordinates: [  0.377215380000000,  0.868602540000000,  0.574021100000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 30    coordinates: [  0.508612840000000,  0.377215380000000,  0.425978900000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 31    coordinates: [  0.868602540000000,  0.491387160000000,  0.425978900000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 32    coordinates: [  0.622784620000000,  0.131397460000000,  0.425978900000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 33    coordinates: [  0.036096470000000,  0.189172630000000,  0.272962170000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 34    coordinates: [  0.153076160000000,  0.963903530000000,  0.272962170000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 35    coordinates: [  0.810827370000000,  0.846923840000000,  0.272962170000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 36    coordinates: [  0.963903530000000,  0.810827370000000,  0.727037830000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 37    coordinates: [  0.394919550000000,  0.299473310000000,  0.877017540000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 38    coordinates: [  0.700526690000000,  0.095446250000000,  0.877017540000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 39    coordinates: [  0.904553750000000,  0.605080450000000,  0.877017540000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 40    coordinates: [  0.938413780000000,  0.367193360000000,  0.789649130000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 41    coordinates: [  0.632806640000000,  0.571220420000000,  0.789649130000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 42    coordinates: [  0.428779580000000,  0.061586220000000,  0.789649130000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 43    coordinates: [  0.855839300000000,  0.486409490000000,  0.060371160000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 44    coordinates: [  0.513590510000000,  0.369429810000000,  0.060371160000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 45    coordinates: [  0.158053830000000,  0.956117960000000,  0.907354430000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 46    coordinates: [  0.798064130000000,  0.841946170000000,  0.907354430000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 47    coordinates: [  0.043882040000000,  0.201935870000000,  0.907354430000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 48    coordinates: [  0.175279500000000,  0.710548710000000,  0.759312240000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 49    coordinates: [  0.535269210000000,  0.824720500000000,  0.759312240000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 50    coordinates: [  0.289451290000000,  0.464730790000000,  0.759312240000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 51    coordinates: [  0.702763140000000,  0.522505960000000,  0.606295500000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 52    coordinates: [  0.819742830000000,  0.297236860000000,  0.606295500000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 53    coordinates: [  0.477494040000000,  0.180257170000000,  0.606295500000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 54    coordinates: [  0.630570190000000,  0.144160700000000,  0.060371160000000 ]    mass: 15.999400    reduced_to: 18  - symbol: In # 55    coordinates: [  0.333333330000000,  0.666666670000000,  0.489149100000000 ]    mass: 114.818000    reduced_to: 55  - symbol: In # 56    coordinates: [  0.333333330000000,  0.666666670000000,  0.844184240000000 ]    mass: 114.818000    reduced_to: 56  - symbol: In # 57    coordinates: [  0.000000000000000,  0.000000000000000,  0.822482430000000 ]    mass: 114.818000    reduced_to: 55  - symbol: In # 58    coordinates: [  0.000000000000000,  0.000000000000000,  0.177517570000000 ]    mass: 114.818000    reduced_to: 56  - symbol: In # 59    coordinates: [  0.666666670000000,  0.333333330000000,  0.155815760000000 ]    mass: 114.818000    reduced_to: 55  - symbol: In # 60    coordinates: [  0.666666670000000,  0.333333330000000,  0.510850900000000 ]    mass: 114.818000    reduced_to: 56  - symbol: I  # 61    coordinates: [  0.624996880000000,  0.953146950000000,  0.085285960000000 ]    mass: 126.904470    reduced_to: 61  - symbol: I  # 62    coordinates: [  0.619813610000000,  0.661483390000000,  0.248047370000000 ]    mass: 126.904470    reduced_to: 62  - symbol: I  # 63    coordinates: [  0.338516610000000,  0.958330210000000,  0.248047370000000 ]    mass: 126.904470    reduced_to: 63  - symbol: I  # 64    coordinates: [  0.041669790000000,  0.380186390000000,  0.248047370000000 ]    mass: 126.904470    reduced_to: 64  - symbol: I  # 65    coordinates: [  0.328150060000000,  0.375003120000000,  0.085285960000000 ]    mass: 126.904470    reduced_to: 65  - symbol: I  # 66    coordinates: [  0.046853050000000,  0.671849940000000,  0.085285960000000 ]    mass: 126.904470    reduced_to: 66  - symbol: I  # 67    coordinates: [  0.291663550000000,  0.286480280000000,  0.418619290000000 ]    mass: 126.904470    reduced_to: 61  - symbol: I  # 68    coordinates: [  0.286480280000000,  0.994816720000000,  0.581380710000000 ]    mass: 126.904470    reduced_to: 62  - symbol: I  # 69    coordinates: [  0.005183280000000,  0.291663550000000,  0.581380710000000 ]    mass: 126.904470    reduced_to: 63  - symbol: I  # 70    coordinates: [  0.708336450000000,  0.713519720000000,  0.581380710000000 ]    mass: 126.904470    reduced_to: 64  - symbol: I  # 71    coordinates: [  0.994816720000000,  0.708336450000000,  0.418619290000000 ]    mass: 126.904470    reduced_to: 65  - symbol: I  # 72    coordinates: [  0.713519720000000,  0.005183280000000,  0.418619290000000 ]    mass: 126.904470    reduced_to: 66  - symbol: I  # 73    coordinates: [  0.958330210000000,  0.619813610000000,  0.751952630000000 ]    mass: 126.904470    reduced_to: 61  - symbol: I  # 74    coordinates: [  0.953146950000000,  0.328150060000000,  0.914714040000000 ]    mass: 126.904470    reduced_to: 62  - symbol: I  # 75    coordinates: [  0.671849940000000,  0.624996880000000,  0.914714040000000 ]    mass: 126.904470    reduced_to: 63  - symbol: I  # 76    coordinates: [  0.375003120000000,  0.046853050000000,  0.914714040000000 ]    mass: 126.904470    reduced_to: 64  - symbol: I  # 77    coordinates: [  0.661483390000000,  0.041669790000000,  0.751952630000000 ]    mass: 126.904470    reduced_to: 65  - symbol: I  # 78    coordinates: [  0.380186390000000,  0.338516610000000,  0.751952630000000 ]    mass: 126.904470    reduced_to: 66supercell:  lattice:  - [     9.657302440000000,     0.000000010000000,     0.000000000000000 ] # a  - [    -4.828651230000000,     8.363469230000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    14.285824650000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.061586220000000,  0.632806640000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.367193360000000,  0.428779580000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.571220420000000,  0.938413780000000,  0.210350870000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.605080450000000,  0.700526690000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.299473310000000,  0.904553750000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.095446250000000,  0.394919550000000,  0.122982460000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.522505960000000,  0.819742830000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.180257170000000,  0.702763140000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.824720500000000,  0.289451290000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.464730790000000,  0.175279500000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.710548710000000,  0.535269210000000,  0.240687760000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.841946170000000,  0.043882040000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.201935870000000,  0.158053830000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.956117960000000,  0.798064130000000,  0.092645570000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.369429810000000,  0.855839300000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.486409490000000,  0.630570190000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.144160700000000,  0.513590510000000,  0.939628840000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.297236860000000,  0.477494040000000,  0.393704500000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.728252890000000,  0.966139970000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 20    coordinates: [  0.033860030000000,  0.762112920000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 21    coordinates: [  0.237887080000000,  0.271747110000000,  0.543684200000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 22    coordinates: [  0.271747110000000,  0.033860030000000,  0.456315800000000 ]    mass: 15.999400    reduced_to: 4  - 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