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"results": [
{
"id": "jvasp-38836",
"created_at": "2022-09-04T14:37:55.207229Z",
"updated_at": "2022-09-04T14:37:55.207253Z",
"structure_string": "Nd2 Zn1 Ir1\n1.0\n0.000000 3.597441 3.597441\n3.597441 0.000000 3.597441\n3.597441 3.597441 0.000000\nNd Zn Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Nd\n0.749999 0.749999 0.749999 Zn\n0.249999 0.249999 0.249999 Ir\n",
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{
"id": "jvasp-99569",
"created_at": "2022-09-04T14:36:13.683320Z",
"updated_at": "2022-09-04T14:36:13.683340Z",
"structure_string": "Ni1 Ir3\n1.0\n3.472645 0.005477 -3.127685\n-0.684520 3.404516 -3.127685\n-0.004479 -0.005477 4.673506\nNi Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Ni\n0.750001 0.250001 0.500000 Ir\n0.250000 0.750001 0.500000 Ir\n0.500001 0.500001 0.000000 Ir\n",
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"formula_full": "Ni1 Ir3",
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},
{
"id": "jvasp-103060",
"created_at": "2022-09-04T14:36:58.064076Z",
"updated_at": "2022-09-04T14:36:58.064101Z",
"structure_string": "Ni1 Ir1\n1.0\n2.554439 -0.000625 3.642974\n1.149496 2.281187 3.642974\n-0.001015 -0.000625 4.449316\nNi Ir\n1 1\ndirect\n0.500001 0.499998 0.500000 Ni\n0.000000 0.000000 0.000000 Ir\n",
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"elements": [
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"chemical_system": "Ir-Ni",
"density": 16.06089331054305,
"density_atomic": 0.07709601537509592,
"volume": 25.941677922904088,
"volume_molar": 7.811221800115642,
"formula_full": "Ni1 Ir1",
"formula_reduced": "NiIr",
"formula_anonymous": "AB",
"energy_above_hull": 1.89383675,
"spacegroup": 166
},
{
"id": "jvasp-59573",
"created_at": "2022-09-04T14:37:05.678574Z",
"updated_at": "2022-09-04T14:37:05.678604Z",
"structure_string": "Sr6 Ni2 Ir2 O12\n1.0\n6.696320 0.028220 -0.202586\n-0.209659 6.693097 -0.202586\n0.027235 0.028220 6.699329\nSr Ni Ir O\n6 2 2 12\ndirect\n0.385941 0.114059 0.750000 Sr\n0.885941 0.250001 0.614059 Sr\n0.249999 0.614059 0.885940 Sr\n0.114058 0.750000 0.385941 Sr\n0.614057 0.885942 0.249999 Sr\n0.749999 0.385941 0.114058 Sr\n0.250000 0.249999 0.250000 Ni\n0.750000 0.750000 0.749999 Ni\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.499999 Ir\n0.093339 0.287225 0.963060 O\n0.787224 0.593340 0.463060 O\n0.536938 0.212775 0.406660 O\n0.406660 0.536940 0.212776 O\n0.212776 0.406661 0.536939 O\n0.712776 0.036940 0.906661 O\n0.906661 0.712777 0.036938 O\n0.036939 0.906662 0.712775 O\n0.463060 0.787224 0.593339 O\n0.593338 0.463060 0.787224 O\n0.963060 0.093339 0.287223 O\n0.287223 0.963061 0.093338 O\n",
"nsites": 22,
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"elements": [
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"Ir",
"O"
],
"chemical_system": "Ir-Ni-O-Sr",
"density": 6.741874278950239,
"density_atomic": 0.07324204515382235,
"volume": 300.3739171099848,
"volume_molar": 8.222245497585913,
"formula_full": "Sr6 Ni2 Ir2 O12",
"formula_reduced": "Sr3NiIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.83588213,
"spacegroup": 167
},
{
"id": "jvasp-79883",
"created_at": "2022-09-04T14:37:17.328727Z",
"updated_at": "2022-09-04T14:37:17.328741Z",
"structure_string": "Pm2 Ni1 Ir1\n1.0\n-0.000000 3.489717 3.489717\n3.489717 -0.000000 3.489717\n3.489717 3.489717 0.000000\nPm Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.750002 0.750002 0.750002 Ni\n0.250001 0.250001 0.250001 Ir\n",
"nsites": 4,
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"elements": [
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"Ni",
"Ir"
],
"chemical_system": "Ir-Ni-Pm",
"density": 10.56753770651144,
"density_atomic": 0.047060806800691427,
"volume": 84.99641786721836,
"volume_molar": 12.7965098123042,
"formula_full": "Pm2 Ni1 Ir1",
"formula_reduced": "Pm2NiIr",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-38404",
"created_at": "2022-09-04T14:38:07.365939Z",
"updated_at": "2022-09-04T14:38:07.365966Z",
"structure_string": "Pr2 Ni1 Ir1\n1.0\n-0.000000 3.547013 3.547013\n3.547013 0.000000 3.547013\n3.547013 3.547013 -0.000000\nPr Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499999 0.499999 0.499999 Pr\n0.749999 0.749999 0.749999 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
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"elements": [
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"Ir"
],
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"density": 9.911386453001331,
"density_atomic": 0.04481688371134184,
"volume": 89.25207798389867,
"volume_molar": 13.437214418538371,
"formula_full": "Pr2 Ni1 Ir1",
"formula_reduced": "Pr2NiIr",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-41868",
"created_at": "2022-09-04T14:37:42.598315Z",
"updated_at": "2022-09-04T14:37:42.598337Z",
"structure_string": "Sc2 Ni1 Ir1\n1.0\n0.000000 3.193773 3.193773\n3.193773 0.000000 3.193773\n3.193773 3.193773 0.000000\nSc Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.500001 Sc\n0.749998 0.749998 0.749998 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
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"elements": [
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"Ni",
"Ir"
],
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"density": 8.686300961766657,
"density_atomic": 0.06139285927969233,
"volume": 65.15415712724638,
"volume_molar": 9.809187632985873,
"formula_full": "Sc2 Ni1 Ir1",
"formula_reduced": "Sc2NiIr",
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"spacegroup": 225
},
{
"id": "jvasp-40567",
"created_at": "2022-09-04T14:37:46.596879Z",
"updated_at": "2022-09-04T14:37:46.596902Z",
"structure_string": "Sm2 Ni1 Ir1\n1.0\n0.000000 3.467691 3.467691\n3.467691 -0.000000 3.467691\n3.467691 3.467691 0.000000\nSm Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.499999 0.499999 0.499999 Sm\n0.750001 0.750001 0.750001 Ni\n0.250001 0.250001 0.250001 Ir\n",
"nsites": 4,
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"elements": [
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],
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"density": 10.98363569460849,
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"volume": 83.39714234821363,
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"formula_full": "Sm2 Ni1 Ir1",
"formula_reduced": "Sm2NiIr",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-51144",
"created_at": "2022-09-04T14:36:42.789073Z",
"updated_at": "2022-09-04T14:36:42.789092Z",
"structure_string": "Sr1 Ni1 Ir2\n1.0\n-0.000000 3.271496 3.271496\n3.271496 0.000000 3.271496\n3.271496 3.271496 -0.000000\nSr Ni Ir\n1 1 2\ndirect\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Ni\n0.250000 0.250000 0.250000 Ir\n0.750001 0.750001 0.750001 Ir\n",
"nsites": 4,
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"elements": [
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],
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"density": 12.58542240153656,
"density_atomic": 0.05712034406748086,
"volume": 70.02758938697005,
"volume_molar": 10.542900009295394,
"formula_full": "Sr1 Ni1 Ir2",
"formula_reduced": "SrNiIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5821502275,
"spacegroup": 225
},
{
"id": "jvasp-41629",
"created_at": "2022-09-04T14:37:30.244985Z",
"updated_at": "2022-09-04T14:37:30.245010Z",
"structure_string": "Ti2 Ni1 Ir1\n1.0\n0.000000 3.064050 3.064050\n3.064051 -0.000000 3.064051\n3.064051 3.064051 -0.000000\nTi Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ti\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
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],
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"formula_full": "Ti2 Ni1 Ir1",
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"spacegroup": 225
},
{
"id": "jvasp-41509",
"created_at": "2022-09-04T14:37:52.213096Z",
"updated_at": "2022-09-04T14:37:52.213123Z",
"structure_string": "Tm2 Ni1 Ir1\n1.0\n-0.000000 3.344854 3.344854\n3.344854 0.000000 3.344854\n3.344854 3.344854 0.000000\nTm Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.499999 0.499999 0.499999 Tm\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
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],
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"volume": 74.84477609190591,
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"formula_full": "Tm2 Ni1 Ir1",
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"formula_anonymous": "ABC2",
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},
{
"id": "jvasp-41554",
"created_at": "2022-09-04T14:37:42.273267Z",
"updated_at": "2022-09-04T14:37:42.273296Z",
"structure_string": "Y2 Ni1 Ir1\n1.0\n0.000000 3.403463 3.403463\n3.403463 0.000000 3.403463\n3.403463 3.403463 0.000000\nY Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.499999 0.499999 0.499999 Y\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
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"volume": 78.84843840738674,
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"formula_full": "Y2 Ni1 Ir1",
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}
]
}