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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1096",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1094",
"results": [
{
"id": "jvasp-18231",
"created_at": "2022-09-04T14:38:13.096728Z",
"updated_at": "2022-09-04T14:38:13.096755Z",
"structure_string": "Mn3 Ir1 N1\n1.0\n3.762562 -0.000000 0.000000\n-0.000000 3.762562 0.000000\n0.000000 0.000000 3.762562\nMn Ir N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 11.566881852497904,
"density_atomic": 0.0938683122357374,
"volume": 53.26611165057688,
"volume_molar": 6.4155204419529985,
"formula_full": "Mn3 Ir1 N1",
"formula_reduced": "Mn3IrN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.748475214827586,
"spacegroup": 221
},
{
"id": "jvasp-116738",
"created_at": "2022-09-04T14:38:44.936017Z",
"updated_at": "2022-09-04T14:38:44.936044Z",
"structure_string": "Mn4 Ir2 N6\n1.0\n5.318569 -0.020745 0.000000\n-2.815457 4.713509 0.000000\n-0.000000 -0.000000 4.949324\nMn Ir N\n4 2 6\ndirect\n0.373667 0.346914 0.494979 Mn\n0.626333 0.973248 0.494979 Mn\n0.626333 0.653087 0.994979 Mn\n0.373667 0.026754 0.994979 Mn\n-0.000000 0.596697 0.494201 Ir\n-0.000000 0.403304 0.994200 Ir\n0.317994 0.314982 0.865117 N\n0.682007 -0.003012 0.865117 N\n0.682006 0.685019 0.365117 N\n0.317994 0.003013 0.365117 N\n-0.000000 0.750431 0.873603 N\n-0.000000 0.249569 0.373604 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 9.23226792540665,
"density_atomic": 0.09694138780331933,
"volume": 123.78613791197564,
"volume_molar": 6.212146222022416,
"formula_full": "Mn4 Ir2 N6",
"formula_reduced": "Mn2IrN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.26738255545977,
"spacegroup": 36
},
{
"id": "jvasp-8018",
"created_at": "2022-09-04T14:36:35.922243Z",
"updated_at": "2022-09-04T14:36:35.922269Z",
"structure_string": "Mn2 Ir2\n1.0\n3.658031 0.000000 0.000000\n0.000000 3.764966 0.000000\n0.000000 0.000000 3.764966\nMn Ir\n2 2\ndirect\n0.500000 0.500001 0.000000 Mn\n0.500000 0.000000 0.500001 Mn\n0.000000 0.500001 0.500001 Ir\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Ir"
],
"chemical_system": "Ir-Mn",
"density": 15.829932906936875,
"density_atomic": 0.07714192863825528,
"volume": 51.85247595710705,
"volume_molar": 7.806572724205361,
"formula_full": "Mn2 Ir2",
"formula_reduced": "MnIr",
"formula_anonymous": "AB",
"energy_above_hull": 2.884284170689656,
"spacegroup": 123
},
{
"id": "jvasp-41259",
"created_at": "2022-09-04T14:37:35.352193Z",
"updated_at": "2022-09-04T14:37:35.352220Z",
"structure_string": "Mn2 Ir6\n1.0\n2.714051 -4.700874 0.000000\n2.714051 4.700874 -0.000000\n0.000000 -0.000000 4.298805\nMn Ir\n2 6\ndirect\n0.333333 0.666667 0.749999 Mn\n0.666667 0.333333 0.250000 Mn\n0.660437 0.830219 0.250000 Ir\n0.169781 0.830219 0.250000 Ir\n0.169781 0.339562 0.250000 Ir\n0.339562 0.169781 0.749999 Ir\n0.830219 0.169781 0.749999 Ir\n0.830219 0.660437 0.749999 Ir\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Ir"
],
"chemical_system": "Ir-Mn",
"density": 19.12226470069751,
"density_atomic": 0.0729315814636243,
"volume": 109.69184870878081,
"volume_molar": 8.257246914361279,
"formula_full": "Mn2 Ir6",
"formula_reduced": "MnIr3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.495185135344828,
"spacegroup": 194
},
{
"id": "jvasp-41171",
"created_at": "2022-09-04T14:37:38.360043Z",
"updated_at": "2022-09-04T14:37:38.360068Z",
"structure_string": "Mg1 Zr1 Ir2\n1.0\n0.000023 3.210691 3.210691\n3.210691 0.000023 3.210691\n3.210691 3.210691 0.000023\nMg Zr Ir\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Mg\n0.749999 0.749999 0.749999 Zr\n0.999999 0.999999 0.999999 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Zr",
"Ir"
],
"chemical_system": "Ir-Mg-Zr",
"density": 12.541979941086783,
"density_atomic": 0.060428126593705944,
"volume": 66.19434070651184,
"volume_molar": 9.965790931250305,
"formula_full": "Mg1 Zr1 Ir2",
"formula_reduced": "MgZrIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9623039375,
"spacegroup": 225
},
{
"id": "jvasp-119448",
"created_at": "2022-09-04T14:38:33.500647Z",
"updated_at": "2022-09-04T14:38:33.500674Z",
"structure_string": "Y16 Mg4 Ir4\n1.0\n8.393514 0.000000 4.845997\n2.797838 7.913481 4.845997\n-0.000000 -0.000000 9.691995\nY Mg Ir\n16 4 4\ndirect\n0.596648 0.596648 0.596648 Y\n0.186636 0.186636 0.813364 Y\n0.813364 0.813364 0.186636 Y\n0.186636 0.813364 0.186636 Y\n0.813364 0.186636 0.813364 Y\n0.186636 0.813364 0.813364 Y\n0.061549 0.061549 0.438451 Y\n0.438451 0.438451 0.061549 Y\n0.813364 0.186636 0.186636 Y\n0.438451 0.061549 0.438451 Y\n0.438451 0.061549 0.061549 Y\n0.061549 0.438451 0.438451 Y\n0.210055 0.596648 0.596648 Y\n0.596648 0.210055 0.596648 Y\n0.596648 0.596648 0.210056 Y\n0.061549 0.438451 0.061549 Y\n0.829676 0.829676 0.829676 Mg\n0.829676 0.829676 0.510974 Mg\n0.829676 0.510974 0.829676 Mg\n0.510974 0.829676 0.829676 Mg\n0.391054 0.826837 0.391054 Ir\n0.391054 0.391054 0.391054 Ir\n0.391054 0.391054 0.826837 Ir\n0.826837 0.391054 0.391055 Ir\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Y",
"Mg",
"Ir"
],
"chemical_system": "Ir-Mg-Y",
"density": 5.903246725066371,
"density_atomic": 0.03728092481209576,
"volume": 643.7608541356041,
"volume_molar": 16.15341033076015,
"formula_full": "Y16 Mg4 Ir4",
"formula_reduced": "Y4MgIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.768340325,
"spacegroup": 216
},
{
"id": "jvasp-41504",
"created_at": "2022-09-04T14:37:43.100080Z",
"updated_at": "2022-09-04T14:37:43.100104Z",
"structure_string": "Tm2 Mg1 Ir1\n1.0\n-0.000000 3.483952 3.483952\n3.483952 -0.000000 3.483952\n3.483952 3.483952 -0.000000\nTm Mg Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.499999 0.499999 0.499999 Tm\n0.749999 0.749999 0.749999 Mg\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Mg",
"Ir"
],
"chemical_system": "Ir-Mg-Tm",
"density": 10.884746776721748,
"density_atomic": 0.0472948123807963,
"volume": 84.57587203843458,
"volume_molar": 12.733195157880031,
"formula_full": "Tm2 Mg1 Ir1",
"formula_reduced": "Tm2MgIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4777596624999998,
"spacegroup": 225
},
{
"id": "jvasp-41161",
"created_at": "2022-09-04T14:37:41.112578Z",
"updated_at": "2022-09-04T14:37:41.112603Z",
"structure_string": "Mg1 Ti1 Ir2\n1.0\n0.000019 3.095544 3.095544\n3.095544 0.000019 3.095544\n3.095544 3.095544 0.000019\nMg Ti Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mg\n0.749999 0.749999 0.749999 Ti\n0.000002 0.000002 0.000002 Ir\n0.499997 0.499997 0.499997 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"Ir"
],
"chemical_system": "Ir-Mg-Ti",
"density": 12.780674371401055,
"density_atomic": 0.06742532520282242,
"volume": 59.324889987072105,
"volume_molar": 8.93157095184157,
"formula_full": "Mg1 Ti1 Ir2",
"formula_reduced": "MgTiIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.843059895833333,
"spacegroup": 225
},
{
"id": "jvasp-76235",
"created_at": "2022-09-04T14:37:05.328896Z",
"updated_at": "2022-09-04T14:37:05.328929Z",
"structure_string": "Tb16 Mg4 Ir4\n1.0\n8.390647 0.000000 4.844342\n2.796883 7.910778 4.844342\n-0.000000 0.000000 9.688685\nTb Mg Ir\n16 4 4\ndirect\n0.811952 0.811952 0.188048 Tb\n0.040562 0.653146 0.653146 Tb\n0.653146 0.040562 0.653146 Tb\n0.188048 0.811952 0.188048 Tb\n0.436438 0.436438 0.063562 Tb\n0.436438 0.063562 0.436438 Tb\n0.063562 0.436438 0.436438 Tb\n0.188048 0.811952 0.811951 Tb\n0.063562 0.063562 0.436438 Tb\n0.811952 0.188048 0.188048 Tb\n0.063562 0.436438 0.063562 Tb\n0.653146 0.653146 0.653146 Tb\n0.653146 0.653146 0.040562 Tb\n0.436438 0.063562 0.063562 Tb\n0.188048 0.188048 0.811951 Tb\n0.811952 0.188048 0.811951 Tb\n0.420209 0.739374 0.420208 Mg\n0.739374 0.420209 0.420208 Mg\n0.420209 0.420209 0.420208 Mg\n0.420209 0.420209 0.739373 Mg\n0.858576 0.858576 0.858575 Ir\n0.858576 0.424273 0.858575 Ir\n0.424273 0.858576 0.858576 Ir\n0.858576 0.858576 0.424273 Ir\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Ir"
],
"chemical_system": "Ir-Mg-Tb",
"density": 8.802034362882875,
"density_atomic": 0.0373191512408289,
"volume": 643.1014426111298,
"volume_molar": 16.136864209847023,
"formula_full": "Tb16 Mg4 Ir4",
"formula_reduced": "Tb4MgIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6794656249999995,
"spacegroup": 216
},
{
"id": "jvasp-39974",
"created_at": "2022-09-04T14:37:50.522046Z",
"updated_at": "2022-09-04T14:37:50.522070Z",
"structure_string": "Mg1 Ta1 Ir2\n1.0\n-0.000000 3.161425 3.161425\n3.161425 0.000000 3.161425\n3.161425 3.161425 -0.000000\nMg Ta Ir\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Mg\n0.750001 0.750001 0.750001 Ta\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ta",
"Ir"
],
"chemical_system": "Ir-Mg-Ta",
"density": 15.495012008161039,
"density_atomic": 0.0632967404146981,
"volume": 63.19440738643727,
"volume_molar": 9.514140413147723,
"formula_full": "Mg1 Ta1 Ir2",
"formula_reduced": "MgTaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.6233601125,
"spacegroup": 225
},
{
"id": "jvasp-41159",
"created_at": "2022-09-04T14:37:34.514112Z",
"updated_at": "2022-09-04T14:37:34.514137Z",
"structure_string": "Mg1 Sn1 Ir2\n1.0\n0.000003 3.184121 3.184120\n3.184124 -0.000000 3.184123\n3.184122 3.184121 0.000002\nMg Sn Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mg\n0.750000 0.749999 0.749999 Sn\n0.000000 0.000000 0.000000 Ir\n0.500000 0.499999 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sn",
"Ir"
],
"chemical_system": "Ir-Mg-Sn",
"density": 13.565346329607646,
"density_atomic": 0.06195285237683852,
"volume": 64.56522737111982,
"volume_molar": 9.72052218575721,
"formula_full": "Mg1 Sn1 Ir2",
"formula_reduced": "MgSnIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1152207375,
"spacegroup": 225
},
{
"id": "jvasp-37271",
"created_at": "2022-09-04T14:38:06.043247Z",
"updated_at": "2022-09-04T14:38:06.043273Z",
"structure_string": "Sm2 Mg1 Ir1\n1.0\n-0.000000 3.605695 3.605695\n3.605695 0.000000 3.605695\n3.605695 3.605695 -0.000000\nSm Mg Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Sm\n0.750001 0.750001 0.750001 Mg\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Mg",
"Ir"
],
"chemical_system": "Ir-Mg-Sm",
"density": 9.161064083439982,
"density_atomic": 0.04266414362400675,
"volume": 93.75554412275216,
"volume_molar": 14.115227093440106,
"formula_full": "Sm2 Mg1 Ir1",
"formula_reduced": "Sm2MgIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.601036975,
"spacegroup": 225
}
]
}