# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/cea56745-d995-4f49-8ba5-170f271ca108/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 Na4B2O5 / C2/c (15) / materials id 27564](https://mdr.nims.go.jp/datasets/a94a3fa6-1881-44a7-b94c-e21fdb564b4f)

## 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:  - [     5.321110175000000,    -3.995829875000000,    -0.000882905000000 ] # a  - [     5.321110175000000,     3.995829875000000,    -0.000882905000000 ] # b  - [    -2.177634790000000,     0.000000000000000,     5.866436770000000 ] # c  points:  - symbol: B  # 1    coordinates: [  0.071041510000000,  0.746734750000000,  0.333499040000000 ]    mass: 10.811000  - symbol: B  # 2    coordinates: [  0.253265250000000,  0.928958490000000,  0.166500960000000 ]    mass: 10.811000  - symbol: B  # 3    coordinates: [  0.928958490000000,  0.253265250000000,  0.666500960000000 ]    mass: 10.811000  - symbol: B  # 4    coordinates: [  0.746734750000000,  0.071041510000000,  0.833499040000000 ]    mass: 10.811000  - symbol: O  # 5    coordinates: [  0.927803000000000,  0.072197000000000,  0.750000000000000 ]    mass: 15.999400  - symbol: O  # 6    coordinates: [  0.072197000000000,  0.927803000000000,  0.250000000000000 ]    mass: 15.999400  - symbol: O  # 7    coordinates: [  0.652129810000000,  0.258167870000000,  0.960611400000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.741832130000000,  0.347870190000000,  0.539388600000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.880728510000000,  0.685860890000000,  0.285493390000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.314139110000000,  0.119271490000000,  0.214506610000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.119271490000000,  0.314139110000000,  0.714506610000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.685860890000000,  0.880728510000000,  0.785493390000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.258167870000000,  0.652129810000000,  0.460611400000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.347870190000000,  0.741832130000000,  0.039388600000000 ]    mass: 15.999400  - symbol: Na # 15    coordinates: [  0.967810020000000,  0.315546940000000,  0.273101600000000 ]    mass: 22.989769  - symbol: Na # 16    coordinates: [  0.684453060000000,  0.032189980000000,  0.226898400000000 ]    mass: 22.989769  - symbol: Na # 17    coordinates: [  0.032189980000000,  0.684453060000000,  0.726898400000000 ]    mass: 22.989769  - symbol: Na # 18    coordinates: [  0.315546940000000,  0.967810020000000,  0.773101600000000 ]    mass: 22.989769  - symbol: Na # 19    coordinates: [  0.670731840000000,  0.596512540000000,  0.925014620000000 ]    mass: 22.989769  - symbol: Na # 20    coordinates: [  0.403487460000000,  0.329268160000000,  0.574985380000000 ]    mass: 22.989769  - symbol: Na # 21    coordinates: [  0.329268160000000,  0.403487460000000,  0.074985380000000 ]    mass: 22.989769  - symbol: Na # 22    coordinates: [  0.596512540000000,  0.670731840000000,  0.425014620000000 ]    mass: 22.989769  reciprocal_lattice: # without 2pi  - [     0.093971141606756,    -0.125130452406961,     0.034882303388209 ] # a*  - [     0.093971141606756,     0.125130452406961,     0.034882303388209 ] # b*  - [     0.000028285514370,     0.000000000000000,     0.170471724954797 ] # c*unit_cell:  lattice:  - [    10.642220350000001,     0.000000000000000,    -0.001765810000000 ] # a  - [     0.000000000000000,     7.991659750000000,     0.000000000000000 ] # b  - [    -2.177634790000000,     0.000000000000000,     5.866436770000000 ] # c  points:  - symbol: B  # 1    coordinates: [  0.408888130000000,  0.337846620000000,  0.333499040000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 2    coordinates: [  0.591111870000000,  0.337846620000000,  0.166500960000000 ]    mass: 10.811000    reduced_to: 2  - symbol: B  # 3    coordinates: [  0.591111870000000,  0.662153380000000,  0.666500960000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 4    coordinates: [  0.408888130000000,  0.662153380000000,  0.833499040000000 ]    mass: 10.811000    reduced_to: 4  - symbol: B  # 5    coordinates: [  0.908888130000000,  0.837846620000000,  0.333499040000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 6    coordinates: [  0.091111870000000,  0.837846620000000,  0.166500960000000 ]    mass: 10.811000    reduced_to: 2  - symbol: B  # 7    coordinates: [  0.091111870000000,  0.162153380000000,  0.666500960000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 8    coordinates: [  0.908888130000000,  0.162153380000000,  0.833499040000000 ]    mass: 10.811000    reduced_to: 4  - symbol: O  # 9    coordinates: [  0.500000000000000,  0.572197000000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.500000000000000,  0.427803000000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.455148840000000,  0.803019030000000,  0.960611400000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.544851160000000,  0.803019030000000,  0.539388600000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.783294700000000,  0.902566190000000,  0.285493390000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.216705300000000,  0.902566190000000,  0.214506610000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.216705300000000,  0.097433810000000,  0.714506610000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.783294700000000,  0.097433810000000,  0.785493390000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.455148840000000,  0.196980970000000,  0.460611400000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.544851160000000,  0.196980970000000,  0.039388600000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.000000000000000,  0.072197000000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 20    coordinates: [  0.000000000000000,  0.927803000000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 21    coordinates: [  0.955148840000000,  0.303019030000000,  0.960611400000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 22    coordinates: [  0.044851160000000,  0.303019030000000,  0.539388600000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 23    coordinates: [  0.283294700000000,  0.402566190000000,  0.285493390000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 24    coordinates: [  0.716705300000000,  0.402566190000000,  0.214506610000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 25    coordinates: [  0.716705300000000,  0.597433810000000,  0.714506610000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 26    coordinates: [  0.283294700000000,  0.597433810000000,  0.785493390000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 27    coordinates: [  0.955148840000000,  0.696980970000000,  0.460611400000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 28    coordinates: [  0.044851160000000,  0.696980970000000,  0.039388600000000 ]    mass: 15.999400    reduced_to: 18  - symbol: Na # 29    coordinates: [  0.641678480000000,  0.673868460000000,  0.273101600000000 ]    mass: 22.989769    reduced_to: 29  - symbol: Na # 30    coordinates: [  0.358321520000000,  0.673868460000000,  0.226898400000000 ]    mass: 22.989769    reduced_to: 30  - symbol: Na # 31    coordinates: [  0.358321520000000,  0.326131540000000,  0.726898400000000 ]    mass: 22.989769    reduced_to: 31  - symbol: Na # 32    coordinates: [  0.641678480000000,  0.326131540000000,  0.773101600000000 ]    mass: 22.989769    reduced_to: 32  - symbol: Na # 33    coordinates: [  0.633622190000000,  0.962890350000000,  0.925014620000000 ]    mass: 22.989769    reduced_to: 33  - symbol: Na # 34    coordinates: [  0.366377810000000,  0.962890350000000,  0.574985380000000 ]    mass: 22.989769    reduced_to: 34  - symbol: Na # 35    coordinates: [  0.366377810000000,  0.037109650000000,  0.074985380000000 ]    mass: 22.989769    reduced_to: 35  - symbol: Na # 36    coordinates: [  0.633622190000000,  0.037109650000000,  0.425014620000000 ]    mass: 22.989769    reduced_to: 36  - symbol: Na # 37    coordinates: [  0.141678480000000,  0.173868460000000,  0.273101600000000 ]    mass: 22.989769    reduced_to: 29  - symbol: Na # 38    coordinates: [  0.858321520000000,  0.173868460000000,  0.226898400000000 ]    mass: 22.989769    reduced_to: 30  - symbol: Na # 39    coordinates: [  0.858321520000000,  0.826131540000000,  0.726898400000000 ]    mass: 22.989769    reduced_to: 31  - symbol: Na # 40    coordinates: [  0.141678480000000,  0.826131540000000,  0.773101600000000 ]    mass: 22.989769    reduced_to: 32  - symbol: Na # 41    coordinates: [  0.133622190000000,  0.462890350000000,  0.925014620000000 ]    mass: 22.989769    reduced_to: 33  - symbol: Na # 42    coordinates: [  0.866377810000000,  0.462890350000000,  0.574985380000000 ]    mass: 22.989769    reduced_to: 34  - symbol: Na # 43    coordinates: [  0.866377810000000,  0.537109650000000,  0.074985380000000 ]    mass: 22.989769    reduced_to: 35  - symbol: Na # 44    coordinates: [  0.133622190000000,  0.537109650000000,  0.425014620000000 ]    mass: 22.989769    reduced_to: 36supercell:  lattice:  - [    10.642220350000001,     0.000000000000000,    -0.001765810000000 ] # a  - [     0.000000000000000,     7.991659750000000,     0.000000000000000 ] # b  - [    -4.355269580000000,     0.000000000000000,    11.732873540000000 ] # c  points:  - symbol: B  # 1    coordinates: [  0.408888130000000,  0.337846620000000,  0.166749520000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 2    coordinates: [  0.408888130000000,  0.337846620000000,  0.666749520000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 3    coordinates: [  0.591111870000000,  0.337846620000000,  0.083250480000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 4    coordinates: [  0.591111870000000,  0.337846620000000,  0.583250480000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 5    coordinates: [  0.591111870000000,  0.662153380000000,  0.333250480000000 ]    mass: 10.811000    reduced_to: 5  - symbol: B  # 6    coordinates: [  0.591111870000000,  0.662153380000000,  0.833250480000000 ]    mass: 10.811000    reduced_to: 5  - symbol: B  # 7    coordinates: [  0.408888130000000,  0.662153380000000,  0.416749520000000 ]    mass: 10.811000    reduced_to: 7  - symbol: B  # 8    coordinates: [  0.408888130000000,  0.662153380000000,  0.916749520000000 ]    mass: 10.811000    reduced_to: 7  - symbol: B  # 9    coordinates: [  0.908888130000000,  0.837846620000000,  0.166749520000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 10    coordinates: [  0.908888130000000,  0.837846620000000,  0.666749520000000 ]    mass: 10.811000    reduced_to: 1  - symbol: B  # 11    coordinates: [  0.091111870000000,  0.837846620000000,  0.083250480000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 12    coordinates: [  0.091111870000000,  0.837846620000000,  0.583250480000000 ]    mass: 10.811000    reduced_to: 3  - symbol: B  # 13    coordinates: [  0.091111870000000,  0.162153380000000,  0.333250480000000 ]    mass: 10.811000    reduced_to: 5  - symbol: B  # 14    coordinates: [  0.091111870000000,  0.162153380000000,  0.833250480000000 ]    mass: 10.811000    reduced_to: 5  - symbol: B  # 15    coordinates: [  0.908888130000000,  0.162153380000000,  0.416749520000000 ]    mass: 10.811000    reduced_to: 7  - symbol: B  # 16    coordinates: [  0.908888130000000,  0.162153380000000,  0.916749520000000 ]    mass: 10.811000    reduced_to: 7  - symbol: O  # 17    coordinates: [  0.500000000000000,  0.572197000000000,  0.375000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.500000000000000,  0.572197000000000,  0.875000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 19    coordinates: [  0.500000000000000,  0.427803000000000,  0.125000000000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.500000000000000,  0.427803000000000,  0.625000000000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 21    coordinates: [  0.455148840000000,  0.803019030000000,  0.480305700000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.455148840000000,  0.803019030000000,  0.980305700000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 23    coordinates: [  0.544851160000000,  0.803019030000000,  0.269694300000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.544851160000000,  0.803019030000000,  0.769694300000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 25    coordinates: [  0.783294700000000,  0.902566190000000,  0.142746695000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.783294700000000,  0.902566190000000,  0.642746695000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 27    coordinates: [  0.216705300000000,  0.902566190000000,  0.107253305000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.216705300000000,  0.902566190000000,  0.607253305000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 29    coordinates: [  0.216705300000000,  0.097433810000000,  0.357253305000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.216705300000000,  0.097433810000000,  0.857253305000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 31    coordinates: [  0.783294700000000,  0.097433810000000,  0.392746695000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.783294700000000,  0.097433810000000,  0.892746695000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 33    coordinates: [  0.455148840000000,  0.196980970000000,  0.230305700000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.455148840000000,  0.196980970000000,  0.730305700000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 35    coordinates: [  0.544851160000000,  0.196980970000000,  0.019694300000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.544851160000000,  0.196980970000000,  0.519694300000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 37    coordinates: [  0.000000000000000,  0.072197000000000,  0.375000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 38    coordinates: [  0.000000000000000,  0.072197000000000,  0.875000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 39    coordinates: [  0.000000000000000,  0.927803000000000,  0.125000000000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 40    coordinates: [  0.000000000000000,  0.927803000000000,  0.625000000000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 41    coordinates: [  0.955148840000000,  0.303019030000000,  0.480305700000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 42    coordinates: [  0.955148840000000,  0.303019030000000,  0.980305700000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 43    coordinates: [  0.044851160000000,  0.303019030000000,  0.269694300000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 44    coordinates: [  0.044851160000000,  0.303019030000000,  0.769694300000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 45    coordinates: [  0.283294700000000,  0.402566190000000,  0.142746695000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 46    coordinates: [  0.283294700000000,  0.402566190000000,  0.642746695000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 47    coordinates: [  0.716705300000000,  0.402566190000000,  0.107253305000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 48    coordinates: [  0.716705300000000,  0.402566190000000,  0.607253305000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 49    coordinates: [  0.716705300000000,  0.597433810000000,  0.357253305000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 50    coordinates: [  0.716705300000000,  0.597433810000000,  0.857253305000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 51    coordinates: [  0.283294700000000,  0.597433810000000,  0.392746695000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 52    coordinates: [  0.283294700000000,  0.597433810000000,  0.892746695000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 53    coordinates: [  0.955148840000000,  0.696980970000000,  0.230305700000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 54    coordinates: [  0.955148840000000,  0.696980970000000,  0.730305700000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 55    coordinates: [  0.044851160000000,  0.696980970000000,  0.019694300000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 56    coordinates: [  0.044851160000000,  0.696980970000000,  0.519694300000000 ]    mass: 15.999400    reduced_to: 35  - symbol: Na # 57    coordinates: [  0.641678480000000,  0.673868460000000,  0.136550800000000 ]    mass: 22.989769    reduced_to: 57  - symbol: Na # 58    coordinates: [  0.641678480000000,  0.673868460000000,  0.636550800000000 ]    mass: 22.989769    reduced_to: 57  - symbol: Na # 59    coordinates: [  0.358321520000000,  0.673868460000000,  0.113449200000000 ]    mass: 22.989769    reduced_to: 59  - symbol: Na # 60    coordinates: [  0.358321520000000,  0.673868460000000,  0.613449200000000 ]    mass: 22.989769    reduced_to: 59  - symbol: Na # 61    coordinates: [  0.358321520000000,  0.326131540000000,  0.363449200000000 ]    mass: 22.989769    reduced_to: 61  - symbol: Na # 62    coordinates: [  0.358321520000000,  0.326131540000000,  0.863449200000000 ]    mass: 22.989769    reduced_to: 61  - symbol: Na # 63    coordinates: [  0.641678480000000,  0.326131540000000,  0.386550800000000 ]    mass: 22.989769    reduced_to: 63  - symbol: Na # 64    coordinates: [  0.641678480000000,  0.326131540000000,  0.886550800000000 ]    mass: 22.989769    reduced_to: 63  - symbol: Na # 65    coordinates: [  0.633622190000000,  0.962890350000000,  0.462507310000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 66    coordinates: [  0.633622190000000,  0.962890350000000,  0.962507310000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 67    coordinates: [  0.366377810000000,  0.962890350000000,  0.287492690000000 ]    mass: 22.989769    reduced_to: 67  - symbol: Na # 68    coordinates: [  0.366377810000000,  0.962890350000000,  0.787492690000000 ]    mass: 22.989769    reduced_to: 67  - symbol: Na # 69    coordinates: [  0.366377810000000,  0.037109650000000,  0.037492690000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 70    coordinates: [  0.366377810000000,  0.037109650000000,  0.537492690000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 71    coordinates: [  0.633622190000000,  0.037109650000000,  0.212507310000000 ]    mass: 22.989769    reduced_to: 71  - symbol: Na # 72    coordinates: [  0.633622190000000,  0.037109650000000,  0.712507310000000 ]    mass: 22.989769    reduced_to: 71  - symbol: Na # 73    coordinates: [  0.141678480000000,  0.173868460000000,  0.136550800000000 ]    mass: 22.989769    reduced_to: 57  - symbol: Na # 74    coordinates: [  0.141678480000000,  0.173868460000000,  0.636550800000000 ]    mass: 22.989769    reduced_to: 57  - symbol: Na # 75    coordinates: [  0.858321520000000,  0.173868460000000,  0.113449200000000 ]    mass: 22.989769    reduced_to: 59  - symbol: Na # 76    coordinates: [  0.858321520000000,  0.173868460000000,  0.613449200000000 ]    mass: 22.989769    reduced_to: 59  - 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