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{
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{
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{
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{
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{
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{
"id": "mp-555484",
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"structure_string": "V2 S4 Br4 N6\n1.0\n6.056906 0.000000 0.000000\n-2.436838 -7.481134 0.000000\n-1.393961 0.129124 -8.187722\nV S Br N\n2 4 4 6\ndirect\n0.240502 0.003303 0.134815 V\n0.759498 0.996697 0.865185 V\n0.786668 0.709013 0.202064 S\n0.778459 0.266396 0.582101 S\n0.221541 0.733604 0.417899 S\n0.213332 0.290987 0.797936 S\n0.263836 0.277920 0.269436 Br\n0.663499 0.200630 0.063255 Br\n0.336501 0.799370 0.936745 Br\n0.736164 0.722080 0.730564 Br\n0.333742 0.894386 0.305974 N\n0.666258 0.105614 0.694026 N\n0.070628 0.124703 0.894257 N\n0.944543 0.650251 0.352418 N\n0.055457 0.349749 0.647582 N\n0.929372 0.875297 0.105743 N\n",
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{
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{
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{
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{
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"volume_molar": 100.31124023473956,
"formula_full": "Al1 Fe1 Ir2",
"formula_reduced": "AlFeIr2",
"formula_anonymous": "ABC2",
"energy": -18.10704513,
"energy_per_atom": -4.5267612825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.10704513,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0002654,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:30.886000Z",
"spacegroup": 71
}
]
}