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"results": [
{
"id": "mp-1104136",
"created_at": "2022-09-04T14:42:10.636745Z",
"structure_string": "Er6 Pt8\n1.0\n4.238015 -6.564426 0.000000\n4.238015 6.564426 0.000000\n-5.929880 0.000000 5.088123\nEr Pt\n6 8\ndirect\n0.026362 0.281415 0.403666 Er\n0.281415 0.403666 0.026362 Er\n0.403666 0.026362 0.281415 Er\n0.973638 0.718585 0.596334 Er\n0.718585 0.596334 0.973638 Er\n0.596334 0.973638 0.718585 Er\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n0.061034 0.551975 0.224886 Pt\n0.551975 0.224886 0.061034 Pt\n0.224886 0.061034 0.551975 Pt\n0.938966 0.448025 0.775114 Pt\n0.448025 0.775114 0.938966 Pt\n0.775114 0.938966 0.448025 Pt\n",
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"spacegroup": 148
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{
"id": "mp-1754",
"created_at": "2022-09-04T14:42:39.714687Z",
"structure_string": "U1 Hg2\n1.0\n2.591948 -4.489385 0.000000\n2.591948 4.489385 0.000000\n0.000000 0.000000 3.032676\nU Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.333333 0.666667 0.500000 Hg\n0.666667 0.333333 0.500000 Hg\n",
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"spacegroup": 191
},
{
"id": "mp-1178924",
"created_at": "2022-09-04T14:43:00.135629Z",
"structure_string": "Tm2 B8 Ir8\n1.0\n5.394864 0.000000 0.000000\n0.000000 5.394864 0.000000\n0.000000 0.000000 7.445035\nTm B Ir\n2 8 8\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Tm\n0.827547 0.500000 0.153188 B\n0.172453 0.500000 0.153188 B\n0.000000 0.327547 0.653188 B\n0.000000 0.672453 0.653188 B\n0.672453 0.000000 0.346812 B\n0.327547 0.000000 0.346812 B\n0.500000 0.172453 0.846812 B\n0.500000 0.827547 0.846812 B\n0.251130 0.500000 0.855061 Ir\n0.748870 0.500000 0.855061 Ir\n0.000000 0.751130 0.355061 Ir\n0.000000 0.248870 0.355061 Ir\n0.248870 0.000000 0.644939 Ir\n0.751130 0.000000 0.644939 Ir\n0.500000 0.748870 0.144939 Ir\n0.500000 0.251130 0.144939 Ir\n",
"nsites": 18,
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"elements": [
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"density_atomic": 0.08307010500293918,
"volume": 216.684449831418,
"volume_molar": 7.249468096599765,
"formula_full": "Tm2 B8 Ir8",
"formula_reduced": "Tm(BIr)4",
"formula_anonymous": "AB4C4",
"energy": -142.29509691,
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"total_magnetization": 5.52e-05,
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"updated_at": "2021-11-28T01:36:01.882000Z",
"spacegroup": 137
},
{
"id": "mp-1211262",
"created_at": "2022-09-04T14:45:11.164141Z",
"structure_string": "La2 B2 Pt8\n1.0\n2.770843 -4.799241 0.000000\n2.770843 4.799241 0.000000\n0.000000 0.000000 7.724076\nLa B Pt\n2 2 8\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.500000 Pt\n0.666667 0.333333 0.500000 Pt\n0.500000 0.000000 0.198488 Pt\n0.500000 0.000000 0.801512 Pt\n0.000000 0.500000 0.198488 Pt\n0.000000 0.500000 0.801512 Pt\n0.500000 0.500000 0.198488 Pt\n0.500000 0.500000 0.801512 Pt\n",
"nsites": 12,
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"elements": [
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"chemical_system": "B-La-Pt",
"density": 15.035765084737633,
"density_atomic": 0.058414442234129844,
"volume": 205.42864985174424,
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"formula_full": "La2 B2 Pt8",
"formula_reduced": "LaBPt4",
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"updated_at": "2021-11-28T01:36:47.461000Z",
"spacegroup": 191
},
{
"id": "mp-1184485",
"created_at": "2022-09-04T14:46:52.329908Z",
"structure_string": "Gd1 Lu1 Ir2\n1.0\n0.000000 3.408596 3.408596\n3.408596 0.000000 3.408596\n3.408596 3.408596 0.000000\nGd Lu Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Gd\n0.000000 0.000000 0.000000 Lu\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Ir\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Gd-Ir-Lu",
"density": 15.024506743630031,
"density_atomic": 0.0505013985836772,
"volume": 79.2057272111442,
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"formula_full": "Gd1 Lu1 Ir2",
"formula_reduced": "GdLuIr2",
"formula_anonymous": "ABC2",
"energy": -39.6282741,
"energy_per_atom": -9.907068525,
"energy_above_hull": null,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.025000Z",
"spacegroup": 225
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{
"id": "mp-3702",
"created_at": "2022-09-04T14:40:43.876368Z",
"structure_string": "Fe1 Cu1 Pt2\n1.0\n3.962795 0.000000 0.000000\n0.000000 3.962795 0.000000\n0.000000 0.000000 3.586566\nFe Cu Pt\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
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"elements": [
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"Cu",
"Pt"
],
"chemical_system": "Cu-Fe-Pt",
"density": 15.023168359633305,
"density_atomic": 0.07101955577599857,
"volume": 56.32251506354565,
"volume_molar": 8.479552841747307,
"formula_full": "Fe1 Cu1 Pt2",
"formula_reduced": "FeCuPt2",
"formula_anonymous": "ABC2",
"energy": -25.42066364,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:10.966000Z",
"spacegroup": 123
},
{
"id": "mp-1079681",
"created_at": "2022-09-04T14:45:54.989710Z",
"structure_string": "Zr2 Au6\n1.0\n4.892013 0.000000 0.000000\n0.000000 4.975106 0.000000\n0.000000 0.000000 6.198056\nZr Au\n2 6\ndirect\n0.500000 0.661064 0.500000 Zr\n0.000000 0.338936 0.000000 Zr\n0.500000 0.164368 0.753343 Au\n0.500000 0.164368 0.246657 Au\n0.000000 0.835632 0.746657 Au\n0.000000 0.835632 0.253343 Au\n0.000000 0.341004 0.500000 Au\n0.500000 0.658996 0.000000 Au\n",
"nsites": 8,
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"elements": [
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],
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"density": 15.017470936785928,
"density_atomic": 0.05303279914989797,
"volume": 150.85004239334765,
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"formula_full": "Zr2 Au6",
"formula_reduced": "ZrAu3",
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"total_magnetization": 6.4e-05,
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"updated_at": "2021-11-28T01:37:07.673000Z",
"spacegroup": 59
},
{
"id": "mp-1009648",
"created_at": "2022-09-04T14:44:28.968832Z",
"structure_string": "Pt1 C1\n1.0\n1.514186 -2.622648 0.000000\n1.514186 2.622648 0.000000\n0.000000 0.000000 2.883999\nPt C\n1 1\ndirect\n0.000000 0.000000 0.000000 Pt\n0.333333 0.666667 0.500000 C\n",
"nsites": 2,
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"elements": [
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"density": 15.01321655259429,
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"volume": 22.905740327603738,
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"formula_full": "Pt1 C1",
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"updated_at": "2021-11-28T01:36:43.665000Z",
"spacegroup": 187
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{
"id": "mp-2109",
"created_at": "2022-09-04T14:47:45.122809Z",
"structure_string": "Ce2 Pt4\n1.0\n0.000000 3.885372 3.885372\n3.885372 0.000000 3.885372\n3.885372 3.885372 0.000000\nCe Pt\n2 4\ndirect\n0.750000 0.750000 0.750000 Ce\n0.500000 0.500000 0.500000 Ce\n0.125000 0.625000 0.125000 Pt\n0.125000 0.125000 0.625000 Pt\n0.625000 0.125000 0.125000 Pt\n0.125000 0.125000 0.125000 Pt\n",
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"volume": 117.30804955403399,
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"formula_full": "Ce2 Pt4",
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{
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"structure_string": "Nd1 In1 Pt4\n1.0\n0.000000 3.859529 3.859529\n3.859529 0.000000 3.859529\n3.859529 3.859529 0.000000\nNd In Pt\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250000 0.250000 0.250000 In\n0.624395 0.624395 0.126816 Pt\n0.624395 0.126816 0.624395 Pt\n0.126816 0.624395 0.624395 Pt\n0.624395 0.624395 0.624395 Pt\n",
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"updated_at": "2021-11-28T01:36:56.833000Z",
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{
"id": "mp-867280",
"created_at": "2022-09-04T14:45:11.267187Z",
"structure_string": "Be2 Ir1 Pt1\n1.0\n0.000000 2.819767 2.819767\n2.819767 0.000000 2.819767\n2.819767 2.819767 0.000000\nBe Ir Pt\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Be\n0.250000 0.250000 0.250000 Be\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Pt\n",
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{
"id": "mp-2570",
"created_at": "2022-09-04T14:44:01.325913Z",
"structure_string": "Pu2 Fe4\n1.0\n0.000000 3.401506 3.401506\n3.401506 0.000000 3.401506\n3.401506 3.401506 0.000000\nPu Fe\n2 4\ndirect\n0.250000 0.250000 0.250000 Pu\n0.000000 0.000000 0.000000 Pu\n0.625000 0.125000 0.625000 Fe\n0.625000 0.625000 0.125000 Fe\n0.125000 0.625000 0.625000 Fe\n0.625000 0.625000 0.625000 Fe\n",
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"volume": 78.71250243476572,
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"formula_full": "Pu2 Fe4",
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"updated_at": "2021-11-28T01:36:26.530000Z",
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]
}