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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3550",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3548",
"results": [
{
"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-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-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-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-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-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-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-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-112726",
"created_at": "2022-09-04T14:38:41.946661Z",
"updated_at": "2022-09-04T14:38:41.946684Z",
"structure_string": "Mn8 Ir2 N8\n1.0\n5.196009 -0.026889 2.120587\n2.214870 4.378905 2.938358\n0.009296 0.024164 7.752843\nMn Ir N\n8 2 8\ndirect\n0.737786 0.582830 0.224801 Mn\n0.262216 0.417168 0.775200 Mn\n0.694349 0.204073 0.018428 Mn\n0.305653 0.795925 0.981572 Mn\n0.754655 0.515222 0.579730 Mn\n0.245347 0.484776 0.420270 Mn\n0.287381 0.950865 0.591507 Mn\n0.712621 0.049133 0.408494 Mn\n0.208387 0.060305 0.220789 Ir\n0.791615 0.939693 0.779212 Ir\n0.953334 0.665757 0.609582 N\n0.046668 0.334241 0.390419 N\n0.940058 0.800338 0.024255 N\n0.059944 0.199659 0.975746 N\n0.471192 0.559914 0.807323 N\n0.528810 0.440084 0.192678 N\n0.560282 0.866832 0.361425 N\n0.439720 0.133166 0.638575 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 8.805040396317537,
"density_atomic": 0.10197240030606947,
"volume": 176.51835149484685,
"volume_molar": 5.9056575523618005,
"formula_full": "Mn8 Ir2 N8",
"formula_reduced": "Mn4IrN4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 5.531525896168581,
"spacegroup": 2
},
{
"id": "jvasp-107200",
"created_at": "2022-09-04T14:36:56.684850Z",
"updated_at": "2022-09-04T14:36:56.684874Z",
"structure_string": "Mn2 Ir1 Rh1\n1.0\n3.712013 -0.000000 2.143132\n1.237338 3.499719 2.143132\n-0.000000 -0.000000 4.286263\nMn Ir Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.750000 0.750000 0.749999 Mn\n0.500000 0.500000 0.499999 Ir\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"Rh"
],
"chemical_system": "Ir-Mn-Rh",
"density": 12.077613557594779,
"density_atomic": 0.07183539963816182,
"volume": 55.68285302438884,
"volume_molar": 8.383249470781532,
"formula_full": "Mn2 Ir1 Rh1",
"formula_reduced": "Mn2IrRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.967314645689655,
"spacegroup": 225
},
{
"id": "jvasp-15904",
"created_at": "2022-09-04T14:36:43.862017Z",
"updated_at": "2022-09-04T14:36:43.862043Z",
"structure_string": "Mn1 Sb1 Ir1\n1.0\n3.745002 -0.000000 2.162178\n1.248334 3.530822 2.162178\n-0.000000 -0.000000 4.324356\nMn Sb Ir\n1 1 1\ndirect\n0.499999 0.500000 0.500002 Mn\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250001 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mn",
"Sb",
"Ir"
],
"chemical_system": "Ir-Mn-Sb",
"density": 10.713371049726993,
"density_atomic": 0.05246527299898605,
"volume": 57.18068025792944,
"volume_molar": 11.478336842193473,
"formula_full": "Mn1 Sb1 Ir1",
"formula_reduced": "MnSbIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0600981471264364,
"spacegroup": 216
},
{
"id": "jvasp-23690",
"created_at": "2022-09-04T14:38:35.752538Z",
"updated_at": "2022-09-04T14:38:35.752566Z",
"structure_string": "Mn4 Si4 Ir4\n1.0\n3.943793 0.000000 0.000000\n0.000000 5.117155 0.000000\n0.000000 0.000000 7.486305\nMn Si Ir\n4 4 4\ndirect\n0.749999 0.970781 0.221193 Mn\n0.250000 0.029218 0.778807 Mn\n0.749999 0.470782 0.278807 Mn\n0.250000 0.529217 0.721192 Mn\n0.250000 0.186238 0.109003 Si\n0.749999 0.813761 0.890997 Si\n0.250000 0.686237 0.390997 Si\n0.749999 0.313762 0.609002 Si\n0.250000 0.682060 0.060000 Ir\n0.749999 0.317939 0.940000 Ir\n0.250000 0.182061 0.440000 Ir\n0.749999 0.817938 0.559999 Ir\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Si",
"Ir"
],
"chemical_system": "Ir-Mn-Si",
"density": 12.100722379571595,
"density_atomic": 0.0794275278294977,
"volume": 151.0811217209187,
"volume_molar": 7.58193150985055,
"formula_full": "Mn4 Si4 Ir4",
"formula_reduced": "MnSiIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.4539789804597696,
"spacegroup": 62
}
]
}