# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/b2fc2f06-09a4-45b2-8f2c-73cf55a55d66/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 Sr(H2O3)2 / C2/c (15) / materials id 625812](https://mdr.nims.go.jp/datasets/a77d676f-f4b8-492a-bf2b-5df208cd15d9)

## 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: "C2/c"  number: 15  Hall_symbol: "-C 2yc"primitive_matrix:- [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [ -0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [  0.000000000000000,  0.000000000000000,  1.000000000000000 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   2 ]primitive_cell:  lattice:  - [     3.877118380000000,    -4.260364635000000,    -0.080180150000000 ] # a  - [     3.877118380000000,     4.260364635000000,    -0.080180150000000 ] # b  - [    -0.186506330000000,     0.000000000000000,     6.024794790000000 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.812846320000000,  0.187153680000000,  0.250000000000000 ]    mass: 87.620000  - symbol: Sr # 2    coordinates: [  0.187153680000000,  0.812846320000000,  0.750000000000000 ]    mass: 87.620000  - symbol: H  # 3    coordinates: [  0.981510420000000,  0.323389880000000,  0.760713920000000 ]    mass: 1.007940  - symbol: H  # 4    coordinates: [  0.676610120000000,  0.018489580000000,  0.739286080000000 ]    mass: 1.007940  - symbol: H  # 5    coordinates: [  0.018489580000000,  0.676610120000000,  0.239286080000000 ]    mass: 1.007940  - symbol: H  # 6    coordinates: [  0.323389880000000,  0.981510420000000,  0.260713920000000 ]    mass: 1.007940  - symbol: H  # 7    coordinates: [  0.380682730000000,  0.288324370000000,  0.572455740000000 ]    mass: 1.007940  - symbol: H  # 8    coordinates: [  0.288324370000000,  0.380682730000000,  0.072455740000000 ]    mass: 1.007940  - symbol: H  # 9    coordinates: [  0.619317270000000,  0.711675630000000,  0.427544260000000 ]    mass: 1.007940  - symbol: H  # 10    coordinates: [  0.711675630000000,  0.619317270000000,  0.927544260000000 ]    mass: 1.007940  - symbol: O  # 11    coordinates: [  0.055584270000000,  0.225621290000000,  0.625472520000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.774378710000000,  0.944415730000000,  0.874527480000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.944415730000000,  0.774378710000000,  0.374527480000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.225621290000000,  0.055584270000000,  0.125472520000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.245654030000000,  0.397536890000000,  0.569133240000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.602463110000000,  0.754345970000000,  0.930866760000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.754345970000000,  0.602463110000000,  0.430866760000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.397536890000000,  0.245654030000000,  0.069133240000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.099726080000000,  0.540575860000000,  0.076366890000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.459424140000000,  0.900273920000000,  0.423633110000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.900273920000000,  0.459424140000000,  0.923633110000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.540575860000000,  0.099726080000000,  0.576366890000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.129044370377378,    -0.117360846508858,     0.003994757127030 ] # a*  - [     0.129044370377378,     0.117360846508858,     0.003994757127030 ] # b*  - [     0.003434738388331,     0.000000000000000,     0.166087084345543 ] # c*unit_cell:  lattice:  - [     7.754236760000000,     0.000000000000000,    -0.160360300000000 ] # a  - [     0.000000000000000,     8.520729270000000,     0.000000000000000 ] # b  - [    -0.186506330000000,     0.000000000000000,     6.024794790000000 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.500000000000000,  0.687153680000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 2    coordinates: [  0.500000000000000,  0.312846320000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 2  - symbol: Sr # 3    coordinates: [  0.000000000000000,  0.187153680000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 4    coordinates: [  0.000000000000000,  0.812846320000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 2  - symbol: H  # 5    coordinates: [  0.152450150000000,  0.170939730000000,  0.760713920000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.847549850000000,  0.170939730000000,  0.739286080000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 7    coordinates: [  0.847549850000000,  0.829060270000000,  0.239286080000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.152450150000000,  0.829060270000000,  0.260713920000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.334503550000000,  0.953820820000000,  0.572455740000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.334503550000000,  0.046179180000000,  0.072455740000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.665496450000000,  0.046179180000000,  0.427544260000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.665496450000000,  0.953820820000000,  0.927544260000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 13    coordinates: [  0.652450150000000,  0.670939730000000,  0.760713920000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 14    coordinates: [  0.347549850000000,  0.670939730000000,  0.739286080000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 15    coordinates: [  0.347549850000000,  0.329060270000000,  0.239286080000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 16    coordinates: [  0.652450150000000,  0.329060270000000,  0.260713920000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 17    coordinates: [  0.834503550000000,  0.453820820000000,  0.572455740000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 18    coordinates: [  0.834503550000000,  0.546179180000000,  0.072455740000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 19    coordinates: [  0.165496450000000,  0.546179180000000,  0.427544260000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 20    coordinates: [  0.165496450000000,  0.453820820000000,  0.927544260000000 ]    mass: 1.007940    reduced_to: 12  - symbol: O  # 21    coordinates: [  0.140602780000000,  0.085018510000000,  0.625472520000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.859397220000000,  0.085018510000000,  0.874527480000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.859397220000000,  0.914981490000000,  0.374527480000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.140602780000000,  0.914981490000000,  0.125472520000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 25    coordinates: [  0.321595460000000,  0.075941430000000,  0.569133240000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.678404540000000,  0.075941430000000,  0.930866760000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.678404540000000,  0.924058570000000,  0.430866760000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.321595460000000,  0.924058570000000,  0.069133240000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.320150970000000,  0.220424890000000,  0.076366890000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.679849030000000,  0.220424890000000,  0.423633110000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.679849030000000,  0.779575110000000,  0.923633110000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.320150970000000,  0.779575110000000,  0.576366890000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.640602780000000,  0.585018510000000,  0.625472520000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 34    coordinates: [  0.359397220000000,  0.585018510000000,  0.874527480000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 35    coordinates: [  0.359397220000000,  0.414981490000000,  0.374527480000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 36    coordinates: [  0.640602780000000,  0.414981490000000,  0.125472520000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 37    coordinates: [  0.821595460000000,  0.575941430000000,  0.569133240000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 38    coordinates: [  0.178404540000000,  0.575941430000000,  0.930866760000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 39    coordinates: [  0.178404540000000,  0.424058570000000,  0.430866760000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 40    coordinates: [  0.821595460000000,  0.424058570000000,  0.069133240000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 41    coordinates: [  0.820150970000000,  0.720424890000000,  0.076366890000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 42    coordinates: [  0.179849030000000,  0.720424890000000,  0.423633110000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 43    coordinates: [  0.179849030000000,  0.279575110000000,  0.923633110000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 44    coordinates: [  0.820150970000000,  0.279575110000000,  0.576366890000000 ]    mass: 15.999400    reduced_to: 32supercell:  lattice:  - [     7.754236760000000,     0.000000000000000,    -0.160360300000000 ] # a  - [     0.000000000000000,     8.520729270000000,     0.000000000000000 ] # b  - [    -0.373012660000000,     0.000000000000000,    12.049589579999999 ] # c  points:  - symbol: Sr # 1    coordinates: [  0.500000000000000,  0.687153680000000,  0.125000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 2    coordinates: [  0.500000000000000,  0.687153680000000,  0.625000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 3    coordinates: [  0.500000000000000,  0.312846320000000,  0.375000000000000 ]    mass: 87.620000    reduced_to: 3  - symbol: Sr # 4    coordinates: [  0.500000000000000,  0.312846320000000,  0.875000000000000 ]    mass: 87.620000    reduced_to: 3  - symbol: Sr # 5    coordinates: [  0.000000000000000,  0.187153680000000,  0.125000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 6    coordinates: [  0.000000000000000,  0.187153680000000,  0.625000000000000 ]    mass: 87.620000    reduced_to: 1  - symbol: Sr # 7    coordinates: [  0.000000000000000,  0.812846320000000,  0.375000000000000 ]    mass: 87.620000    reduced_to: 3  - symbol: Sr # 8    coordinates: [  0.000000000000000,  0.812846320000000,  0.875000000000000 ]    mass: 87.620000    reduced_to: 3  - symbol: H  # 9    coordinates: [  0.152450150000000,  0.170939730000000,  0.380356960000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.152450150000000,  0.170939730000000,  0.880356960000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 11    coordinates: [  0.847549850000000,  0.170939730000000,  0.369643040000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.847549850000000,  0.170939730000000,  0.869643040000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 13    coordinates: [  0.847549850000000,  0.829060270000000,  0.119643040000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.847549850000000,  0.829060270000000,  0.619643040000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 15    coordinates: [  0.152450150000000,  0.829060270000000,  0.130356960000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.152450150000000,  0.829060270000000,  0.630356960000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 17    coordinates: [  0.334503550000000,  0.953820820000000,  0.286227870000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 18    coordinates: [  0.334503550000000,  0.953820820000000,  0.786227870000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 19    coordinates: [  0.334503550000000,  0.046179180000000,  0.036227870000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 20    coordinates: [  0.334503550000000,  0.046179180000000,  0.536227870000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 21    coordinates: [  0.665496450000000,  0.046179180000000,  0.213772130000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 22    coordinates: [  0.665496450000000,  0.046179180000000,  0.713772130000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 23    coordinates: [  0.665496450000000,  0.953820820000000,  0.463772130000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 24    coordinates: [  0.665496450000000,  0.953820820000000,  0.963772130000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 25    coordinates: [  0.652450150000000,  0.670939730000000,  0.380356960000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 26    coordinates: [  0.652450150000000,  0.670939730000000,  0.880356960000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 27    coordinates: [  0.347549850000000,  0.670939730000000,  0.369643040000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 28    coordinates: [  0.347549850000000,  0.670939730000000,  0.869643040000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 29    coordinates: [  0.347549850000000,  0.329060270000000,  0.119643040000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 30    coordinates: [  0.347549850000000,  0.329060270000000,  0.619643040000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 31    coordinates: [  0.652450150000000,  0.329060270000000,  0.130356960000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 32    coordinates: [  0.652450150000000,  0.329060270000000,  0.630356960000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 33    coordinates: [  0.834503550000000,  0.453820820000000,  0.286227870000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 34    coordinates: [  0.834503550000000,  0.453820820000000,  0.786227870000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 35    coordinates: [  0.834503550000000,  0.546179180000000,  0.036227870000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 36    coordinates: [  0.834503550000000,  0.546179180000000,  0.536227870000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 37    coordinates: [  0.165496450000000,  0.546179180000000,  0.213772130000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 38    coordinates: [  0.165496450000000,  0.546179180000000,  0.713772130000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 39    coordinates: [  0.165496450000000,  0.453820820000000,  0.463772130000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 40    coordinates: [  0.165496450000000,  0.453820820000000,  0.963772130000000 ]    mass: 1.007940    reduced_to: 23  - symbol: O  # 41    coordinates: [  0.140602780000000,  0.085018510000000,  0.312736260000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.140602780000000,  0.085018510000000,  0.812736260000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 43    coordinates: [  0.859397220000000,  0.085018510000000,  0.437263740000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.859397220000000,  0.085018510000000,  0.937263740000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 45    coordinates: [  0.859397220000000,  0.914981490000000,  0.187263740000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.859397220000000,  0.914981490000000,  0.687263740000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 47    coordinates: [  0.140602780000000,  0.914981490000000,  0.062736260000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.140602780000000,  0.914981490000000,  0.562736260000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 49    coordinates: [  0.321595460000000,  0.075941430000000,  0.284566620000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.321595460000000,  0.075941430000000,  0.784566620000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 51    coordinates: [  0.678404540000000,  0.075941430000000,  0.465433380000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.678404540000000,  0.075941430000000,  0.965433380000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 53    coordinates: [  0.678404540000000,  0.924058570000000,  0.215433380000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 54    coordinates: [  0.678404540000000,  0.924058570000000,  0.715433380000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 55    coordinates: [  0.321595460000000,  0.924058570000000,  0.034566620000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 56    coordinates: [  0.321595460000000,  0.924058570000000,  0.534566620000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 57    coordinates: [  0.320150970000000,  0.220424890000000,  0.038183445000000 ]    mass: 15.999400    reduced_to: 57  - symbol: O  # 58    coordinates: [  0.320150970000000,  0.220424890000000,  0.538183445000000 ]    mass: 15.999400    reduced_to: 57  - symbol: O  # 59    coordinates: [  0.679849030000000,  0.220424890000000,  0.211816555000000 ]    mass: 15.999400    reduced_to: 59  - symbol: O  # 60    coordinates: [  0.679849030000000,  0.220424890000000,  0.711816555000000 ]    mass: 15.999400    reduced_to: 59  - 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