# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/cd2babeb-8b60-43cc-9ede-8d893ea69782/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 CaP2(HO)4 / C2/c (15) / materials id 24130](https://mdr.nims.go.jp/datasets/6cb0630b-ef81-4a0d-853c-256c0999b17c)

## 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,   2,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     7.573560535000000,    -2.833998610000000,     0.024666935000000 ] # a  - [     7.573560535000000,     2.833998610000000,     0.024666935000000 ] # b  - [    -1.386576710000000,     0.000000000000000,     6.372198960000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.902624470000000,  0.536962250000000,  0.629278200000000 ]    mass: 1.007940  - symbol: H  # 2    coordinates: [  0.463037750000000,  0.097375530000000,  0.870721800000000 ]    mass: 1.007940  - symbol: H  # 3    coordinates: [  0.097375530000000,  0.463037750000000,  0.370721800000000 ]    mass: 1.007940  - symbol: H  # 4    coordinates: [  0.536962250000000,  0.902624470000000,  0.129278200000000 ]    mass: 1.007940  - symbol: H  # 5    coordinates: [  0.942892430000000,  0.405717030000000,  0.927455800000000 ]    mass: 1.007940  - symbol: H  # 6    coordinates: [  0.594282970000000,  0.057107570000000,  0.572544200000000 ]    mass: 1.007940  - symbol: H  # 7    coordinates: [  0.057107570000000,  0.594282970000000,  0.072544200000000 ]    mass: 1.007940  - symbol: H  # 8    coordinates: [  0.405717030000000,  0.942892430000000,  0.427455800000000 ]    mass: 1.007940  - symbol: O  # 9    coordinates: [  0.788702740000000,  0.061503160000000,  0.894907400000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.938496840000000,  0.211297260000000,  0.605092600000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.679837330000000,  0.540056930000000,  0.231654200000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.459943070000000,  0.320162670000000,  0.268345800000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.320162670000000,  0.459943070000000,  0.768345800000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.540056930000000,  0.679837330000000,  0.731654200000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.061503160000000,  0.788702740000000,  0.394907400000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.211297260000000,  0.938496840000000,  0.105092600000000 ]    mass: 15.999400  - symbol: P  # 17    coordinates: [  0.823373470000000,  0.460815210000000,  0.720369980000000 ]    mass: 30.973762  - symbol: P  # 18    coordinates: [  0.539184790000000,  0.176626530000000,  0.779630020000000 ]    mass: 30.973762  - symbol: P  # 19    coordinates: [  0.176626530000000,  0.539184790000000,  0.279630020000000 ]    mass: 30.973762  - symbol: P  # 20    coordinates: [  0.460815210000000,  0.823373470000000,  0.220369980000000 ]    mass: 30.973762  - symbol: Ca # 21    coordinates: [  0.166305330000000,  0.833694670000000,  0.750000000000000 ]    mass: 40.078000  - symbol: Ca # 22    coordinates: [  0.833694670000000,  0.166305330000000,  0.250000000000000 ]    mass: 40.078000  reciprocal_lattice: # without 2pi  - [     0.065972390760019,    -0.176429162045355,     0.014355449524580 ] # a*  - [     0.065972390760019,     0.176429162045355,     0.014355449524580 ] # b*  - [    -0.000510761413725,    -0.000000000000000,     0.156820556983890 ] # c*unit_cell:  lattice:  - [    15.147121070000001,     0.000000000000000,     0.049333870000000 ] # a  - [     0.000000000000000,     5.667997220000000,     0.000000000000000 ] # b  - [    -1.386576710000000,     0.000000000000000,     6.372198960000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.719793360000000,  0.817168890000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.780206640000000,  0.317168890000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 3    coordinates: [  0.780206640000000,  0.682831110000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 4    coordinates: [  0.719793360000000,  0.182831110000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 5    coordinates: [  0.674304730000000,  0.731412300000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.825695270000000,  0.231412300000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 7    coordinates: [  0.825695270000000,  0.768587700000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.674304730000000,  0.268587700000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.219793360000000,  0.317168890000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 10    coordinates: [  0.280206640000000,  0.817168890000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 11    coordinates: [  0.280206640000000,  0.182831110000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 12    coordinates: [  0.219793360000000,  0.682831110000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 13    coordinates: [  0.174304730000000,  0.231412300000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 14    coordinates: [  0.325695270000000,  0.731412300000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 15    coordinates: [  0.325695270000000,  0.268587700000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 16    coordinates: [  0.174304730000000,  0.768587700000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: O  # 17    coordinates: [  0.925102950000000,  0.136400210000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.574897050000000,  0.636400210000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.609947130000000,  0.930109800000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.890052870000000,  0.430109800000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 21    coordinates: [  0.890052870000000,  0.569890200000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.609947130000000,  0.069890200000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.925102950000000,  0.863599790000000,  0.394907400000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.574897050000000,  0.363599790000000,  0.105092600000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 25    coordinates: [  0.425102950000000,  0.636400210000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 26    coordinates: [  0.074897050000000,  0.136400210000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 27    coordinates: [  0.109947130000000,  0.430109800000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 28    coordinates: [  0.390052870000000,  0.930109800000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 29    coordinates: [  0.390052870000000,  0.069890200000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 30    coordinates: [  0.109947130000000,  0.569890200000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 31    coordinates: [  0.425102950000000,  0.363599790000000,  0.394907400000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 32    coordinates: [  0.074897050000000,  0.863599790000000,  0.105092600000000 ]    mass: 15.999400    reduced_to: 24  - symbol: P  # 33    coordinates: [  0.642094340000000,  0.818720870000000,  0.720369980000000 ]    mass: 30.973762    reduced_to: 33  - symbol: P  # 34    coordinates: [  0.857905660000000,  0.318720870000000,  0.779630020000000 ]    mass: 30.973762    reduced_to: 34  - symbol: P  # 35    coordinates: [  0.857905660000000,  0.681279130000000,  0.279630020000000 ]    mass: 30.973762    reduced_to: 35  - symbol: P  # 36    coordinates: [  0.642094340000000,  0.181279130000000,  0.220369980000000 ]    mass: 30.973762    reduced_to: 36  - symbol: P  # 37    coordinates: [  0.142094340000000,  0.318720870000000,  0.720369980000000 ]    mass: 30.973762    reduced_to: 33  - symbol: P  # 38    coordinates: [  0.357905660000000,  0.818720870000000,  0.779630020000000 ]    mass: 30.973762    reduced_to: 34  - symbol: P  # 39    coordinates: [  0.357905660000000,  0.181279130000000,  0.279630020000000 ]    mass: 30.973762    reduced_to: 35  - symbol: P  # 40    coordinates: [  0.142094340000000,  0.681279130000000,  0.220369980000000 ]    mass: 30.973762    reduced_to: 36  - symbol: Ca # 41    coordinates: [  0.000000000000000,  0.833694670000000,  0.750000000000000 ]    mass: 40.078000    reduced_to: 41  - symbol: Ca # 42    coordinates: [  0.000000000000000,  0.166305330000000,  0.250000000000000 ]    mass: 40.078000    reduced_to: 42  - symbol: Ca # 43    coordinates: [  0.500000000000000,  0.333694670000000,  0.750000000000000 ]    mass: 40.078000    reduced_to: 41  - symbol: Ca # 44    coordinates: [  0.500000000000000,  0.666305330000000,  0.250000000000000 ]    mass: 40.078000    reduced_to: 42supercell:  lattice:  - [    15.147121070000001,     0.000000000000000,     0.049333870000000 ] # a  - [     0.000000000000000,    11.335994440000000,     0.000000000000000 ] # b  - [    -1.386576710000000,     0.000000000000000,     6.372198960000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.719793360000000,  0.408584445000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.719793360000000,  0.908584445000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 3    coordinates: [  0.780206640000000,  0.158584445000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 4    coordinates: [  0.780206640000000,  0.658584445000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 5    coordinates: [  0.780206640000000,  0.341415555000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.780206640000000,  0.841415555000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 7    coordinates: [  0.719793360000000,  0.091415555000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.719793360000000,  0.591415555000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 9    coordinates: [  0.674304730000000,  0.365706150000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.674304730000000,  0.865706150000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 11    coordinates: [  0.825695270000000,  0.115706150000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.825695270000000,  0.615706150000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 13    coordinates: [  0.825695270000000,  0.384293850000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.825695270000000,  0.884293850000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 15    coordinates: [  0.674304730000000,  0.134293850000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.674304730000000,  0.634293850000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 17    coordinates: [  0.219793360000000,  0.158584445000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 18    coordinates: [  0.219793360000000,  0.658584445000000,  0.629278200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 19    coordinates: [  0.280206640000000,  0.408584445000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 20    coordinates: [  0.280206640000000,  0.908584445000000,  0.870721800000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 21    coordinates: [  0.280206640000000,  0.091415555000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 22    coordinates: [  0.280206640000000,  0.591415555000000,  0.370721800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 23    coordinates: [  0.219793360000000,  0.341415555000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 24    coordinates: [  0.219793360000000,  0.841415555000000,  0.129278200000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 25    coordinates: [  0.174304730000000,  0.115706150000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 26    coordinates: [  0.174304730000000,  0.615706150000000,  0.927455800000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 27    coordinates: [  0.325695270000000,  0.365706150000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 28    coordinates: [  0.325695270000000,  0.865706150000000,  0.572544200000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 29    coordinates: [  0.325695270000000,  0.134293850000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 30    coordinates: [  0.325695270000000,  0.634293850000000,  0.072544200000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 31    coordinates: [  0.174304730000000,  0.384293850000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 32    coordinates: [  0.174304730000000,  0.884293850000000,  0.427455800000000 ]    mass: 1.007940    reduced_to: 15  - symbol: O  # 33    coordinates: [  0.925102950000000,  0.068200105000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.925102950000000,  0.568200105000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 35    coordinates: [  0.574897050000000,  0.318200105000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.574897050000000,  0.818200105000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 37    coordinates: [  0.609947130000000,  0.465054900000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.609947130000000,  0.965054900000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 39    coordinates: [  0.890052870000000,  0.215054900000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.890052870000000,  0.715054900000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 41    coordinates: [  0.890052870000000,  0.284945100000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.890052870000000,  0.784945100000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 43    coordinates: [  0.609947130000000,  0.034945100000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.609947130000000,  0.534945100000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 45    coordinates: [  0.925102950000000,  0.431799895000000,  0.394907400000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.925102950000000,  0.931799895000000,  0.394907400000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 47    coordinates: [  0.574897050000000,  0.181799895000000,  0.105092600000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.574897050000000,  0.681799895000000,  0.105092600000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 49    coordinates: [  0.425102950000000,  0.318200105000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 50    coordinates: [  0.425102950000000,  0.818200105000000,  0.894907400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 51    coordinates: [  0.074897050000000,  0.068200105000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 52    coordinates: [  0.074897050000000,  0.568200105000000,  0.605092600000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 53    coordinates: [  0.109947130000000,  0.215054900000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 54    coordinates: [  0.109947130000000,  0.715054900000000,  0.231654200000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 55    coordinates: [  0.390052870000000,  0.465054900000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 56    coordinates: [  0.390052870000000,  0.965054900000000,  0.268345800000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 57    coordinates: [  0.390052870000000,  0.034945100000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 58    coordinates: [  0.390052870000000,  0.534945100000000,  0.768345800000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 59    coordinates: [  0.109947130000000,  0.284945100000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 60    coordinates: [  0.109947130000000,  0.784945100000000,  0.731654200000000 ]    mass: 15.999400    reduced_to: 43  - 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