# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/7d13936f-e883-4125-81fe-359017654977/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 NaYF4 / I4_1/amd (141) / materials id 34081](https://mdr.nims.go.jp/datasets/05a0ebba-6c6e-4ed9-a66f-0ad564796d22)

## 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: "I4_1/amd"  number: 141  Hall_symbol: "I 4bw 2bw -1bw"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   2,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    -2.703479235000000,     2.703479235000000,     5.326272980000000 ] # a  - [     2.703479235000000,    -2.703479235000000,     5.326272980000000 ] # b  - [     2.703479235000000,     2.703479235000000,    -5.326272980000000 ] # c  points:  - symbol: F  # 1    coordinates: [  0.644128100000000,  0.625000000000000,  0.519128100000000 ]    mass: 18.998403  - symbol: F  # 2    coordinates: [  0.875000000000000,  0.355871900000000,  0.980871900000000 ]    mass: 18.998403  - symbol: F  # 3    coordinates: [  0.105871900000000,  0.625000000000000,  0.980871900000000 ]    mass: 18.998403  - symbol: F  # 4    coordinates: [  0.105871900000000,  0.125000000000000,  0.480871900000000 ]    mass: 18.998403  - symbol: F  # 5    coordinates: [  0.375000000000000,  0.355871900000000,  0.480871900000000 ]    mass: 18.998403  - symbol: F  # 6    coordinates: [  0.644128100000000,  0.125000000000000,  0.019128100000000 ]    mass: 18.998403  - symbol: F  # 7    coordinates: [  0.375000000000000,  0.894128100000000,  0.019128100000000 ]    mass: 18.998403  - symbol: F  # 8    coordinates: [  0.875000000000000,  0.894128100000000,  0.519128100000000 ]    mass: 18.998403  - symbol: Na # 9    coordinates: [  0.250000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 22.989769  - symbol: Na # 10    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 22.989769  - symbol: Y  # 11    coordinates: [  0.750000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 88.905850  - symbol: Y  # 12    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 88.905850  reciprocal_lattice: # without 2pi  - [     0.000000000000000,     0.184946861631804,     0.093874272287111 ] # a*  - [     0.184946861631804,     0.000000000000000,     0.093874272287111 ] # b*  - [     0.184946861631804,     0.184946861631804,     0.000000000000000 ] # c*unit_cell:  lattice:  - [     5.406958470000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     5.406958470000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    10.652545959999999 ] # c  points:  - symbol: F  # 1    coordinates: [  0.250000000000000,  0.269128100000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 2    coordinates: [  0.730871900000000,  0.250000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 2  - symbol: F  # 3    coordinates: [  0.250000000000000,  0.730871900000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 3  - symbol: F  # 4    coordinates: [  0.750000000000000,  0.730871900000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 4  - symbol: F  # 5    coordinates: [  0.730871900000000,  0.750000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 6    coordinates: [  0.750000000000000,  0.269128100000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 6  - symbol: F  # 7    coordinates: [  0.269128100000000,  0.750000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 7  - symbol: F  # 8    coordinates: [  0.269128100000000,  0.250000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 8  - symbol: F  # 9    coordinates: [  0.750000000000000,  0.769128100000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 10    coordinates: [  0.230871900000000,  0.750000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 2  - symbol: F  # 11    coordinates: [  0.750000000000000,  0.230871900000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 3  - symbol: F  # 12    coordinates: [  0.250000000000000,  0.230871900000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 4  - symbol: F  # 13    coordinates: [  0.230871900000000,  0.250000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 14    coordinates: [  0.250000000000000,  0.769128100000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 6  - symbol: F  # 15    coordinates: [  0.769128100000000,  0.250000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 7  - symbol: F  # 16    coordinates: [  0.769128100000000,  0.750000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 8  - symbol: Na # 17    coordinates: [  0.500000000000000,  0.000000000000000,  0.250000000000000 ]    mass: 22.989769    reduced_to: 17  - symbol: Na # 18    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 18  - symbol: Na # 19    coordinates: [  0.000000000000000,  0.500000000000000,  0.750000000000000 ]    mass: 22.989769    reduced_to: 17  - symbol: Na # 20    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 18  - symbol: Y  # 21    coordinates: [  0.000000000000000,  0.500000000000000,  0.250000000000000 ]    mass: 88.905850    reduced_to: 21  - symbol: Y  # 22    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 88.905850    reduced_to: 22  - symbol: Y  # 23    coordinates: [  0.500000000000000,  0.000000000000000,  0.750000000000000 ]    mass: 88.905850    reduced_to: 21  - symbol: Y  # 24    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 88.905850    reduced_to: 22supercell:  lattice:  - [    10.813916940000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    10.813916940000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    10.652545959999999 ] # c  points:  - symbol: F  # 1    coordinates: [  0.125000000000000,  0.134564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 2    coordinates: [  0.625000000000000,  0.134564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 3    coordinates: [  0.125000000000000,  0.634564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 4    coordinates: [  0.625000000000000,  0.634564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 5    coordinates: [  0.365435950000000,  0.125000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 6    coordinates: [  0.865435950000000,  0.125000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 7    coordinates: [  0.365435950000000,  0.625000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 8    coordinates: [  0.865435950000000,  0.625000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 9    coordinates: [  0.125000000000000,  0.365435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 10    coordinates: [  0.625000000000000,  0.365435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 11    coordinates: [  0.125000000000000,  0.865435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 12    coordinates: [  0.625000000000000,  0.865435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 13    coordinates: [  0.375000000000000,  0.365435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 14    coordinates: [  0.875000000000000,  0.365435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 15    coordinates: [  0.375000000000000,  0.865435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 16    coordinates: [  0.875000000000000,  0.865435950000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 17    coordinates: [  0.365435950000000,  0.375000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 18    coordinates: [  0.865435950000000,  0.375000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 19    coordinates: [  0.365435950000000,  0.875000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 20    coordinates: [  0.865435950000000,  0.875000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 21    coordinates: [  0.375000000000000,  0.134564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 22    coordinates: [  0.875000000000000,  0.134564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 23    coordinates: [  0.375000000000000,  0.634564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 24    coordinates: [  0.875000000000000,  0.634564050000000,  0.375000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 25    coordinates: [  0.134564050000000,  0.375000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 26    coordinates: [  0.634564050000000,  0.375000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 27    coordinates: [  0.134564050000000,  0.875000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 28    coordinates: [  0.634564050000000,  0.875000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 29    coordinates: [  0.134564050000000,  0.125000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 30    coordinates: [  0.634564050000000,  0.125000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 31    coordinates: [  0.134564050000000,  0.625000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 32    coordinates: [  0.634564050000000,  0.625000000000000,  0.625000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 33    coordinates: [  0.375000000000000,  0.384564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 34    coordinates: [  0.875000000000000,  0.384564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 35    coordinates: [  0.375000000000000,  0.884564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 36    coordinates: [  0.875000000000000,  0.884564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 1  - symbol: F  # 37    coordinates: [  0.115435950000000,  0.375000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 38    coordinates: [  0.615435950000000,  0.375000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 39    coordinates: [  0.115435950000000,  0.875000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 40    coordinates: [  0.615435950000000,  0.875000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 5  - symbol: F  # 41    coordinates: [  0.375000000000000,  0.115435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 42    coordinates: [  0.875000000000000,  0.115435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 43    coordinates: [  0.375000000000000,  0.615435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 44    coordinates: [  0.875000000000000,  0.615435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 9  - symbol: F  # 45    coordinates: [  0.125000000000000,  0.115435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 46    coordinates: [  0.625000000000000,  0.115435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 47    coordinates: [  0.125000000000000,  0.615435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 48    coordinates: [  0.625000000000000,  0.615435950000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 13  - symbol: F  # 49    coordinates: [  0.115435950000000,  0.125000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 50    coordinates: [  0.615435950000000,  0.125000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 51    coordinates: [  0.115435950000000,  0.625000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 52    coordinates: [  0.615435950000000,  0.625000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 17  - symbol: F  # 53    coordinates: [  0.125000000000000,  0.384564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 54    coordinates: [  0.625000000000000,  0.384564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 55    coordinates: [  0.125000000000000,  0.884564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 56    coordinates: [  0.625000000000000,  0.884564050000000,  0.875000000000000 ]    mass: 18.998403    reduced_to: 21  - symbol: F  # 57    coordinates: [  0.384564050000000,  0.125000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 58    coordinates: [  0.884564050000000,  0.125000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 59    coordinates: [  0.384564050000000,  0.625000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 60    coordinates: [  0.884564050000000,  0.625000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 61    coordinates: [  0.384564050000000,  0.375000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 62    coordinates: [  0.884564050000000,  0.375000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 63    coordinates: [  0.384564050000000,  0.875000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 64    coordinates: [  0.884564050000000,  0.875000000000000,  0.125000000000000 ]    mass: 18.998403    reduced_to: 29  - symbol: Na # 65    coordinates: [  0.250000000000000,  0.000000000000000,  0.250000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 66    coordinates: [  0.750000000000000,  0.000000000000000,  0.250000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 67    coordinates: [  0.250000000000000,  0.500000000000000,  0.250000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 68    coordinates: [  0.750000000000000,  0.500000000000000,  0.250000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 69    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 70    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 71    coordinates: [  0.000000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 72    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 73    coordinates: [  0.000000000000000,  0.250000000000000,  0.750000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 74    coordinates: [  0.500000000000000,  0.250000000000000,  0.750000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 75    coordinates: [  0.000000000000000,  0.750000000000000,  0.750000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 76    coordinates: [  0.500000000000000,  0.750000000000000,  0.750000000000000 ]    mass: 22.989769    reduced_to: 65  - symbol: Na # 77    coordinates: [  0.250000000000000,  0.250000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 78    coordinates: [  0.750000000000000,  0.250000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 79    coordinates: [  0.250000000000000,  0.750000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Na # 80    coordinates: [  0.750000000000000,  0.750000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 69  - symbol: Y  # 81    coordinates: [  0.000000000000000,  0.250000000000000,  0.250000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 82    coordinates: [  0.500000000000000,  0.250000000000000,  0.250000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 83    coordinates: [  0.000000000000000,  0.750000000000000,  0.250000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 84    coordinates: [  0.500000000000000,  0.750000000000000,  0.250000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 85    coordinates: [  0.250000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 86    coordinates: [  0.750000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 87    coordinates: [  0.250000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 88    coordinates: [  0.750000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 89    coordinates: [  0.250000000000000,  0.000000000000000,  0.750000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 90    coordinates: [  0.750000000000000,  0.000000000000000,  0.750000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 91    coordinates: [  0.250000000000000,  0.500000000000000,  0.750000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 92    coordinates: [  0.750000000000000,  0.500000000000000,  0.750000000000000 ]    mass: 88.905850    reduced_to: 81  - symbol: Y  # 93    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 94    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 95    coordinates: [  0.000000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 88.905850    reduced_to: 85  - symbol: Y  # 96    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 88.905850    reduced_to: 85born_effective_charge:- # 1 (F)  - [ -1.234267970000000, -0.000000000000000, -0.459790020000000 ]  - [  0.000000000000000, -1.063603420000000, -0.000000000000000 ]  - [ -0.430013660000000, -0.000000000000000, -1.233698940000000 ]- # 2 (F)  - [ -1.063603420000000, -0.000000000000000, -0.000000000000000 ]  - [ -0.000000000000000, -1.234267970000000,  0.459790020000000 ]  - [  0.000000000000000,  0.430013660000000, -1.233698940000000 ]- # 3 (F)  - [ -1.234267970000000, -0.000000000000000, -0.459790020000000 ]  - [  0.000000000000000, -1.063603420000000, -0.000000000000000 ]  - [ -0.430013660000000, -0.000000000000000, -1.233698940000000 ]- # 4 (F)  - [ -1.234267970000000,  0.000000000000000,  0.459790020000000 ]  - [  0.000000000000000, -1.063603420000000,  0.000000000000000 ]  - [  0.430013660000000, -0.000000000000000, -1.233698940000000 ]- # 5 (F)  - [ -1.063603420000000, -0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -1.234267970000000, -0.459790020000000 ]  - [  0.000000000000000, -0.430013660000000, -1.233698940000000 ]- # 6 (F)  - [ -1.234267970000000,  0.000000000000000,  0.459790020000000 ]  - [  0.000000000000000, -1.063603420000000,  0.000000000000000 ]  - [  0.430013660000000, -0.000000000000000, -1.233698940000000 ]- # 7 (F)  - [ -1.063603420000000, -0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -1.234267970000000, -0.459790020000000 ]  - [  0.000000000000000, -0.430013660000000, -1.233698940000000 ]- # 8 (F)  - [ -1.063603420000000, -0.000000000000000, -0.000000000000000 ]  - [ -0.000000000000000, -1.234267970000000,  0.459790020000000 ]  - [  0.000000000000000,  0.430013660000000, -1.233698940000000 ]- # 9 (Na)  - [  1.134949380000000,  0.000000000000000,  0.000000000000000 ]  - [ -0.000000000000000,  1.134949380000000,  0.000000000000000 ]  - [  0.000000000000000, -0.000000000000000,  1.027204280000000 ]- # 10 (Na)  - [  1.134949380000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  1.134949380000000, -0.000000000000000 ]  - [ -0.000000000000000, -0.000000000000000,  1.027204280000000 ]- # 11 (Y)  - [  3.460793400000000,  0.000000000000000, -0.000000000000000 ]  - [ -0.000000000000000,  3.460793400000000, -0.000000000000000 ]  - [ -0.000000000000000,  0.000000000000000,  3.907591480000000 ]- # 12 (Y)  - [  3.460793400000000, -0.000000000000000, -0.000000000000000 ]  - [  0.000000000000000,  3.460793400000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  3.907591480000000 ]dielectric_constant:  - [  2.257146400000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  2.257146400000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  2.339569660000000 ]displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0557004300000000, -0.0003485700000000, -0.0193792800000000 ]  - [   0.0032216200000000, -0.0000196700000000,  0.0004700000000000 ]  - [  -0.0005596600000000, -0.0000193900000000, -0.0004376900000000 ]  - [   0.0005072600000000, -0.0000194900000000,  0.0001297400000000 ]  - 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