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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1208",
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"results": [
{
"id": "jvasp-22766",
"created_at": "2022-09-04T14:37:38.747026Z",
"updated_at": "2022-09-04T14:37:38.747044Z",
"structure_string": "Tb4 Mg2 Pd4\n1.0\n7.636406 -0.000000 -0.000000\n0.000000 7.636406 0.000000\n0.000000 -0.000000 3.826322\nTb Mg Pd\n4 2 4\ndirect\n0.331903 0.831903 0.500000 Tb\n0.831903 0.668098 0.500000 Tb\n0.168098 0.331903 0.500000 Tb\n0.668098 0.168098 0.500000 Tb\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.133213 0.633214 0.000000 Pd\n0.633214 0.866787 0.000000 Pd\n0.866787 0.366787 0.000000 Pd\n0.366787 0.133213 0.000000 Pd\n",
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"spacegroup": 127
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{
"id": "jvasp-106298",
"created_at": "2022-09-04T14:37:48.020886Z",
"updated_at": "2022-09-04T14:37:48.020919Z",
"structure_string": "Tb4 Mg2 Ni4\n1.0\n7.344235 -0.000000 0.000000\n0.000000 7.344235 0.000000\n0.000000 -0.000000 3.716879\nTb Mg Ni\n4 2 4\ndirect\n0.671274 0.171275 0.500000 Tb\n0.328725 0.828724 0.500000 Tb\n0.171275 0.328725 0.500000 Tb\n0.828724 0.671274 0.500000 Tb\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.123197 0.623196 0.000000 Ni\n0.876803 0.376803 0.000000 Ni\n0.623196 0.876803 0.000000 Ni\n0.376803 0.123197 0.000000 Ni\n",
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"formula_reduced": "Tb2MgNi2",
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"spacegroup": 127
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{
"id": "jvasp-93363",
"created_at": "2022-09-04T14:36:32.052521Z",
"updated_at": "2022-09-04T14:36:32.052549Z",
"structure_string": "Tb2 Mg2 Ni2\n1.0\n-3.648422 0.000000 0.000000\n-0.000000 -0.000000 -3.978204\n1.824210 -8.743622 -0.000000\nTb Mg Ni\n2 2 2\ndirect\n0.586865 0.749999 0.173732 Tb\n0.413134 0.250000 0.826268 Tb\n0.796333 0.749999 0.592666 Mg\n0.203666 0.250000 0.407334 Mg\n0.954938 0.749999 0.909877 Ni\n0.045061 0.250000 0.090122 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"density": 6.331026176319618,
"density_atomic": 0.04727894322349537,
"volume": 126.9063898411817,
"volume_molar": 12.737469049450505,
"formula_full": "Tb2 Mg2 Ni2",
"formula_reduced": "TbMgNi",
"formula_anonymous": "ABC",
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"spacegroup": 63
},
{
"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,
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"elements": [
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"Mg",
"Ir"
],
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"density": 8.802034362882875,
"density_atomic": 0.0373191512408289,
"volume": 643.1014426111298,
"volume_molar": 16.136864209847023,
"formula_full": "Tb16 Mg4 Ir4",
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"formula_anonymous": "ABC4",
"energy_above_hull": 1.6794656249999995,
"spacegroup": 216
},
{
"id": "jvasp-40335",
"created_at": "2022-09-04T14:37:42.781936Z",
"updated_at": "2022-09-04T14:37:42.781960Z",
"structure_string": "Tb1 Mg1 Hg2\n1.0\n0.000000 3.576363 3.576363\n3.576363 0.000000 3.576363\n3.576363 3.576363 0.000000\nTb Mg Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tb\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
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"elements": [
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"Hg"
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"density": 10.607479988183064,
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"volume": 91.48602855545934,
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"formula_full": "Tb1 Mg1 Hg2",
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"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-76249",
"created_at": "2022-09-04T14:37:04.305249Z",
"updated_at": "2022-09-04T14:37:04.305269Z",
"structure_string": "Tb4 Mg2 Ge4\n1.0\n-0.000000 -0.000000 4.252242\n7.266039 0.000000 0.000000\n-0.000000 7.266039 0.000000\nTb Mg Ge\n4 2 4\ndirect\n0.500000 0.177407 0.677407 Tb\n0.500000 0.822593 0.322593 Tb\n0.500000 0.322593 0.177407 Tb\n0.500000 0.677407 0.822593 Tb\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.375944 0.875944 Ge\n0.000000 0.624057 0.124057 Ge\n0.000000 0.124057 0.375944 Ge\n0.000000 0.875944 0.624057 Ge\n",
"nsites": 10,
"nelements": 3,
"elements": [
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"Mg",
"Ge"
],
"chemical_system": "Ge-Mg-Tb",
"density": 7.210792612773039,
"density_atomic": 0.04454372968608368,
"volume": 224.49848879906867,
"volume_molar": 13.51961499955275,
"formula_full": "Tb4 Mg2 Ge4",
"formula_reduced": "Tb2MgGe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6097475499999999,
"spacegroup": 127
},
{
"id": "jvasp-100772",
"created_at": "2022-09-04T14:37:09.920626Z",
"updated_at": "2022-09-04T14:37:09.920649Z",
"structure_string": "Tb3 Mg3 Ga3\n1.0\n7.263001 -0.000000 0.000000\n-3.631500 6.289944 0.000000\n-0.000000 -0.000000 4.411938\nTb Mg Ga\n3 3 3\ndirect\n0.576062 0.000000 -0.000000 Tb\n-0.000000 0.576062 -0.000000 Tb\n0.423937 0.423937 -0.000000 Tb\n0.244359 0.000000 0.500000 Mg\n-0.000000 0.244359 0.500000 Mg\n0.755641 0.755641 0.500000 Mg\n0.333333 0.666666 0.500000 Ga\n0.666666 0.333333 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Ga"
],
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"density": 6.251993300248789,
"density_atomic": 0.044652957192723074,
"volume": 201.55440010738408,
"volume_molar": 13.48654409160029,
"formula_full": "Tb3 Mg3 Ga3",
"formula_reduced": "TbMgGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-107004",
"created_at": "2022-09-04T14:36:43.377740Z",
"updated_at": "2022-09-04T14:36:43.377750Z",
"structure_string": "Tb1 Mg2 Cu1\n1.0\n4.203212 -0.000000 2.426726\n1.401071 3.962827 2.426726\n-0.000000 -0.000000 4.853452\nTb Mg Cu\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.250000 0.250000 0.250000 Mg\n0.749999 0.750001 0.750001 Mg\n0.499999 0.500000 0.500001 Cu\n",
"nsites": 4,
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"elements": [
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"Mg",
"Cu"
],
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"density": 5.5681585073441235,
"density_atomic": 0.04947921989735676,
"volume": 80.84201829167651,
"volume_molar": 12.171050336874266,
"formula_full": "Tb1 Mg2 Cu1",
"formula_reduced": "TbMg2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-101050",
"created_at": "2022-09-04T14:36:35.587826Z",
"updated_at": "2022-09-04T14:36:35.587840Z",
"structure_string": "Tb4 Mg2 Cu4\n1.0\n7.586103 -0.000000 0.000000\n0.000000 7.586103 0.000000\n0.000000 -0.000000 3.702433\nTb Mg Cu\n4 2 4\ndirect\n0.669496 0.169496 0.500000 Tb\n0.330504 0.830504 0.500000 Tb\n0.169496 0.330504 0.500000 Tb\n0.830504 0.669496 0.500000 Tb\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.124460 0.624460 -0.000000 Cu\n0.875539 0.375540 -0.000000 Cu\n0.624460 0.875539 -0.000000 Cu\n0.375540 0.124460 -0.000000 Cu\n",
"nsites": 10,
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"elements": [
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"Mg",
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],
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"density": 7.314027139866608,
"density_atomic": 0.046932676466989946,
"volume": 213.07116390503512,
"volume_molar": 12.831445409331529,
"formula_full": "Tb4 Mg2 Cu4",
"formula_reduced": "Tb2MgCu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.2559276549999998,
"spacegroup": 127
},
{
"id": "jvasp-56188",
"created_at": "2022-09-04T14:37:13.350333Z",
"updated_at": "2022-09-04T14:37:13.350352Z",
"structure_string": "Tb4 Mg3 Co2\n1.0\n0.000000 7.469745 -0.016974\n3.689144 0.000000 0.000000\n0.000000 -2.745876 -7.668782\nTb Mg Co\n4 3 2\ndirect\n0.602166 0.500000 0.824335 Tb\n0.397834 0.500000 0.175664 Tb\n0.096344 0.500000 0.725210 Tb\n0.903656 0.500000 0.274789 Tb\n0.705919 0.000000 0.498491 Mg\n0.000000 0.000000 0.000000 Mg\n0.294080 0.000000 0.501508 Mg\n0.651880 0.000000 0.109606 Co\n0.348120 0.000000 0.890393 Co\n",
"nsites": 9,
"nelements": 3,
"elements": [
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"Mg",
"Co"
],
"chemical_system": "Co-Mg-Tb",
"density": 6.488912527136582,
"density_atomic": 0.04255313068058349,
"volume": 211.5003022352618,
"volume_molar": 14.152051009369881,
"formula_full": "Tb4 Mg3 Co2",
"formula_reduced": "Tb4Mg3Co2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.2593636166666666,
"spacegroup": 10
},
{
"id": "jvasp-42036",
"created_at": "2022-09-04T14:37:40.438668Z",
"updated_at": "2022-09-04T14:37:40.438688Z",
"structure_string": "Tb1 Mg1 Cd2\n1.0\n-0.000000 3.584556 3.584556\n3.584556 -0.000000 3.584556\n3.584556 3.584556 -0.000000\nTb Mg Cd\n1 1 2\ndirect\n0.750002 0.750002 0.750002 Tb\n0.250000 0.250000 0.250000 Mg\n0.500002 0.500002 0.500002 Cd\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
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],
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"density_atomic": 0.04342340617486469,
"volume": 92.1162191628203,
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"formula_full": "Tb1 Mg1 Cd2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-99439",
"created_at": "2022-09-04T14:36:31.655126Z",
"updated_at": "2022-09-04T14:36:31.655150Z",
"structure_string": "Tb3 Mg3 Au3\n1.0\n7.567387 -0.000000 0.000000\n-3.783693 6.553550 0.000000\n-0.000000 -0.000000 4.101043\nTb Mg Au\n3 3 3\ndirect\n0.588906 0.000000 -0.000000 Tb\n0.000000 0.588906 -0.000000 Tb\n0.411094 0.411094 -0.000000 Tb\n0.246446 0.000000 0.500000 Mg\n0.000000 0.246446 0.500000 Mg\n0.753555 0.753554 0.500000 Mg\n0.333334 0.666667 0.500000 Au\n0.666667 0.333333 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
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"formula_full": "Tb3 Mg3 Au3",
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"spacegroup": 189
}
]
}