# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/aaa5d6a2-f9ac-4e9c-ad83-b01fb7bb76b7/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 YWN3 / Pmc2_1 (26) / materials id 989407](https://mdr.nims.go.jp/datasets/dc7b125e-b29a-4b03-a419-bca41f01ecfa)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  nac_unit_conversion_factor: 14.399652  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "Pmc2_1"  number: 26  Hall_symbol: "P 2c -2"supercell_matrix:- [   3,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   2 ]primitive_cell:  lattice:  - [     3.590762640000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     5.899959540000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     5.981204010000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.000000000000000,  0.654380490000000,  0.291547690000000 ]    mass: 88.905850  - symbol: Y  # 2    coordinates: [  0.000000000000000,  0.345619510000000,  0.791547690000000 ]    mass: 88.905850  - symbol: W  # 3    coordinates: [  0.500000000000000,  0.192526430000000,  0.321593760000000 ]    mass: 183.840000  - symbol: W  # 4    coordinates: [  0.500000000000000,  0.807473570000000,  0.821593760000000 ]    mass: 183.840000  - symbol: N  # 5    coordinates: [  0.500000000000000,  0.598658070000000,  0.585515700000000 ]    mass: 14.006700  - symbol: N  # 6    coordinates: [  0.500000000000000,  0.085372060000000,  0.689850830000000 ]    mass: 14.006700  - symbol: N  # 7    coordinates: [  0.000000000000000,  0.271335660000000,  0.416022040000000 ]    mass: 14.006700  - symbol: N  # 8    coordinates: [  0.500000000000000,  0.401341930000000,  0.085515700000000 ]    mass: 14.006700  - symbol: N  # 9    coordinates: [  0.000000000000000,  0.728664340000000,  0.916022040000000 ]    mass: 14.006700  - symbol: N  # 10    coordinates: [  0.500000000000000,  0.914627940000000,  0.189850830000000 ]    mass: 14.006700  reciprocal_lattice: # without 2pi  - [     0.278492370634668,     0.000000000000000,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.169492687741381,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.167190418238217 ] # c*unit_cell:  lattice:  - [     3.590762640000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     5.899959540000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     5.981204010000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.000000000000000,  0.654380490000000,  0.291547690000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 2    coordinates: [  0.000000000000000,  0.345619510000000,  0.791547690000000 ]    mass: 88.905850    reduced_to: 2  - symbol: W  # 3    coordinates: [  0.500000000000000,  0.192526430000000,  0.321593760000000 ]    mass: 183.840000    reduced_to: 3  - symbol: W  # 4    coordinates: [  0.500000000000000,  0.807473570000000,  0.821593760000000 ]    mass: 183.840000    reduced_to: 4  - symbol: N  # 5    coordinates: [  0.500000000000000,  0.598658070000000,  0.585515700000000 ]    mass: 14.006700    reduced_to: 5  - symbol: N  # 6    coordinates: [  0.500000000000000,  0.085372060000000,  0.689850830000000 ]    mass: 14.006700    reduced_to: 6  - symbol: N  # 7    coordinates: [  0.000000000000000,  0.271335660000000,  0.416022040000000 ]    mass: 14.006700    reduced_to: 7  - symbol: N  # 8    coordinates: [  0.500000000000000,  0.401341930000000,  0.085515700000000 ]    mass: 14.006700    reduced_to: 8  - symbol: N  # 9    coordinates: [  0.000000000000000,  0.728664340000000,  0.916022040000000 ]    mass: 14.006700    reduced_to: 9  - symbol: N  # 10    coordinates: [  0.500000000000000,  0.914627940000000,  0.189850830000000 ]    mass: 14.006700    reduced_to: 10supercell:  lattice:  - [    10.772287920000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    11.799919080000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.962408020000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.000000000000000,  0.327190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 2    coordinates: [  0.333333333333333,  0.327190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 3    coordinates: [  0.666666666666667,  0.327190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 4    coordinates: [  0.000000000000000,  0.827190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 5    coordinates: [  0.333333333333333,  0.827190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 6    coordinates: [  0.666666666666667,  0.827190245000000,  0.145773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 7    coordinates: [  0.000000000000000,  0.327190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 8    coordinates: [  0.333333333333333,  0.327190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 9    coordinates: [  0.666666666666667,  0.327190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 10    coordinates: [  0.000000000000000,  0.827190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 11    coordinates: [  0.333333333333333,  0.827190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 12    coordinates: [  0.666666666666667,  0.827190245000000,  0.645773845000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 13    coordinates: [  0.000000000000000,  0.172809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 14    coordinates: [  0.333333333333333,  0.172809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 15    coordinates: [  0.666666666666667,  0.172809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 16    coordinates: [  0.000000000000000,  0.672809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 17    coordinates: [  0.333333333333333,  0.672809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 18    coordinates: [  0.666666666666667,  0.672809755000000,  0.395773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 19    coordinates: [  0.000000000000000,  0.172809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 20    coordinates: [  0.333333333333333,  0.172809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 21    coordinates: [  0.666666666666667,  0.172809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 22    coordinates: [  0.000000000000000,  0.672809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 23    coordinates: [  0.333333333333333,  0.672809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 24    coordinates: [  0.666666666666667,  0.672809755000000,  0.895773845000000 ]    mass: 88.905850    reduced_to: 13  - symbol: W  # 25    coordinates: [  0.166666666666667,  0.096263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 26    coordinates: [  0.500000000000000,  0.096263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 27    coordinates: [  0.833333333333333,  0.096263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 28    coordinates: [  0.166666666666667,  0.596263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 29    coordinates: [  0.500000000000000,  0.596263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 30    coordinates: [  0.833333333333333,  0.596263215000000,  0.160796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 31    coordinates: [  0.166666666666667,  0.096263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 32    coordinates: [  0.500000000000000,  0.096263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 33    coordinates: [  0.833333333333333,  0.096263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 34    coordinates: [  0.166666666666667,  0.596263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 35    coordinates: [  0.500000000000000,  0.596263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 36    coordinates: [  0.833333333333333,  0.596263215000000,  0.660796880000000 ]    mass: 183.840000    reduced_to: 25  - symbol: W  # 37    coordinates: [  0.166666666666667,  0.403736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 38    coordinates: [  0.500000000000000,  0.403736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 39    coordinates: [  0.833333333333333,  0.403736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 40    coordinates: [  0.166666666666667,  0.903736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 41    coordinates: [  0.500000000000000,  0.903736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 42    coordinates: [  0.833333333333333,  0.903736785000000,  0.410796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 43    coordinates: [  0.166666666666667,  0.403736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 44    coordinates: [  0.500000000000000,  0.403736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 45    coordinates: [  0.833333333333333,  0.403736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 46    coordinates: [  0.166666666666667,  0.903736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 47    coordinates: [  0.500000000000000,  0.903736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: W  # 48    coordinates: [  0.833333333333333,  0.903736785000000,  0.910796880000000 ]    mass: 183.840000    reduced_to: 37  - symbol: N  # 49    coordinates: [  0.166666666666667,  0.299329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 50    coordinates: [  0.500000000000000,  0.299329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 51    coordinates: [  0.833333333333333,  0.299329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 52    coordinates: [  0.166666666666667,  0.799329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 53    coordinates: [  0.500000000000000,  0.799329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 54    coordinates: [  0.833333333333333,  0.799329035000000,  0.292757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 55    coordinates: [  0.166666666666667,  0.299329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 56    coordinates: [  0.500000000000000,  0.299329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 57    coordinates: [  0.833333333333333,  0.299329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 58    coordinates: [  0.166666666666667,  0.799329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 59    coordinates: [  0.500000000000000,  0.799329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 60    coordinates: [  0.833333333333333,  0.799329035000000,  0.792757850000000 ]    mass: 14.006700    reduced_to: 49  - symbol: N  # 61    coordinates: [  0.166666666666667,  0.042686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 62    coordinates: [  0.500000000000000,  0.042686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 63    coordinates: [  0.833333333333333,  0.042686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 64    coordinates: [  0.166666666666667,  0.542686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 65    coordinates: [  0.500000000000000,  0.542686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 66    coordinates: [  0.833333333333333,  0.542686030000000,  0.344925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 67    coordinates: [  0.166666666666667,  0.042686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 68    coordinates: [  0.500000000000000,  0.042686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 69    coordinates: [  0.833333333333333,  0.042686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 70    coordinates: [  0.166666666666667,  0.542686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 71    coordinates: [  0.500000000000000,  0.542686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 72    coordinates: [  0.833333333333333,  0.542686030000000,  0.844925415000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 73    coordinates: [  0.000000000000000,  0.135667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 74    coordinates: [  0.333333333333333,  0.135667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 75    coordinates: [  0.666666666666667,  0.135667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 76    coordinates: [  0.000000000000000,  0.635667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 77    coordinates: [  0.333333333333333,  0.635667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 78    coordinates: [  0.666666666666667,  0.635667830000000,  0.208011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 79    coordinates: [  0.000000000000000,  0.135667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 80    coordinates: [  0.333333333333333,  0.135667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 81    coordinates: [  0.666666666666667,  0.135667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 82    coordinates: [  0.000000000000000,  0.635667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 83    coordinates: [  0.333333333333333,  0.635667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 84    coordinates: [  0.666666666666667,  0.635667830000000,  0.708011020000000 ]    mass: 14.006700    reduced_to: 73  - symbol: N  # 85    coordinates: [  0.166666666666667,  0.200670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 86    coordinates: [  0.500000000000000,  0.200670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 87    coordinates: [  0.833333333333333,  0.200670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 88    coordinates: [  0.166666666666667,  0.700670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 89    coordinates: [  0.500000000000000,  0.700670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 90    coordinates: [  0.833333333333333,  0.700670965000000,  0.042757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 91    coordinates: [  0.166666666666667,  0.200670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 92    coordinates: [  0.500000000000000,  0.200670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 93    coordinates: [  0.833333333333333,  0.200670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 94    coordinates: [  0.166666666666667,  0.700670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 95    coordinates: [  0.500000000000000,  0.700670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 96    coordinates: [  0.833333333333333,  0.700670965000000,  0.542757850000000 ]    mass: 14.006700    reduced_to: 85  - symbol: N  # 97    coordinates: [  0.000000000000000,  0.364332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 98    coordinates: [  0.333333333333333,  0.364332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 99    coordinates: [  0.666666666666667,  0.364332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 100    coordinates: [  0.000000000000000,  0.864332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 101    coordinates: [  0.333333333333333,  0.864332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 102    coordinates: [  0.666666666666667,  0.864332170000000,  0.458011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 103    coordinates: [  0.000000000000000,  0.364332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 104    coordinates: [  0.333333333333333,  0.364332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 105    coordinates: [  0.666666666666667,  0.364332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 106    coordinates: [  0.000000000000000,  0.864332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 107    coordinates: [  0.333333333333333,  0.864332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 108    coordinates: [  0.666666666666667,  0.864332170000000,  0.958011020000000 ]    mass: 14.006700    reduced_to: 97  - symbol: N  # 109    coordinates: [  0.166666666666667,  0.457313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 110    coordinates: [  0.500000000000000,  0.457313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 111    coordinates: [  0.833333333333333,  0.457313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 112    coordinates: [  0.166666666666667,  0.957313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 113    coordinates: [  0.500000000000000,  0.957313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 114    coordinates: [  0.833333333333333,  0.957313970000000,  0.094925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 115    coordinates: [  0.166666666666667,  0.457313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 116    coordinates: [  0.500000000000000,  0.457313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 117    coordinates: [  0.833333333333333,  0.457313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 118    coordinates: [  0.166666666666667,  0.957313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 119    coordinates: [  0.500000000000000,  0.957313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109  - symbol: N  # 120    coordinates: [  0.833333333333333,  0.957313970000000,  0.594925415000000 ]    mass: 14.006700    reduced_to: 109born_effective_charge:- # 1 (Y)  - [  3.477867970000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  4.447855090000000, -0.235691340000000 ]  - [  0.000000000000000, -0.610506450000000,  3.896302320000000 ]- # 2 (Y)  - [  3.477867970000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  4.447855090000000,  0.235691340000000 ]  - [  0.000000000000000,  0.610506450000000,  3.896302320000000 ]- # 3 (W)  - [  8.078843050000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  6.433645140000000, -1.485989380000000 ]  - [  0.000000000000000, -0.116321220000000,  4.861051310000000 ]- # 4 (W)  - [  8.078843050000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  6.433645140000000,  1.485989380000000 ]  - [  0.000000000000000,  0.116321220000000,  4.861051310000000 ]- # 5 (N)  - [ -2.960941960000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -3.940295150000000, -1.699409440000000 ]  - [  0.000000000000000, -1.307454820000000, -3.305705310000000 ]- # 6 (N)  - [ -1.885502790000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -4.640273770000000,  1.735255830000000 ]  - [  0.000000000000000,  1.068666140000000, -2.713398330000000 ]- # 7 (N)  - [ -6.710266270000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.300931310000000,  0.044750140000000 ]  - [  0.000000000000000, -0.442062300000000, -2.738249990000000 ]- # 8 (N)  - [ -2.960941960000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -3.940295150000000,  1.699409440000000 ]  - [  0.000000000000000,  1.307454820000000, -3.305705310000000 ]- # 9 (N)  - [ -6.710266270000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.300931310000000, -0.044750140000000 ]  - [  0.000000000000000,  0.442062300000000, -2.738249990000000 ]- # 10 (N)  - [ -1.885502790000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -4.640273770000000, -1.735255830000000 ]  - [  0.000000000000000, -1.068666140000000, -2.713398330000000 ]dielectric_constant:  - [ 10.252194899999999,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, 10.018671919999999,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  8.530408250000001 ]displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0986473200000000, -0.0034408300000000, -0.0015880500000000 ]  - [   0.0181385600000000, -0.0034944200000000, -0.0021229200000000 ]  - [   0.0177850500000000, -0.0029655900000000, -0.0009483900000000 ]  - [  -0.0037472200000000, -0.0032186800000000, -0.0015255500000000 ]  - [   0.0018585900000000, -0.0029993000000000, -0.0014097800000000 ]  - [   0.0018554200000000, -0.0034499200000000, -0.0016525900000000 ]  - [  -0.0013328600000000, -0.0032292500000000, -0.0015162200000000 ]  - [   0.0006477300000000, -0.0034520100000000, -0.0010781300000000 ]  - [   0.0006451700000000, -0.0030060500000000, -0.0019780200000000 ]  - [  -0.0011125300000000, -0.0032272200000000, -0.0015297300000000 ]  - [   0.0005622400000000, -0.0032127600000000, -0.0015675000000000 ]  - 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