HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4184",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4182",
"results": [
{
"id": "jvasp-90125",
"created_at": "2022-09-04T14:35:49.783785Z",
"updated_at": "2022-09-04T14:35:49.783815Z",
"structure_string": "V3 Fe3 As3\n1.0\n0.000000 0.000000 -3.691084\n-3.022034 -5.234316 0.000000\n-3.021863 5.234217 0.000000\nV Fe As\n3 3 3\ndirect\n0.499999 0.581445 -0.000001 V\n0.499999 0.418586 0.418619 V\n0.499999 0.999965 0.581379 V\n0.000000 0.246636 -0.000000 Fe\n0.000000 0.753331 0.753358 Fe\n0.000000 0.999973 0.246640 Fe\n0.000000 0.333303 0.666669 As\n0.000000 0.666635 0.333330 As\n0.499999 0.000021 -0.000000 As\n",
"nsites": 9,
"nelements": 3,
"elements": [
"V",
"Fe",
"As"
],
"chemical_system": "As-Fe-V",
"density": 7.752072496945818,
"density_atomic": 0.07707538371894054,
"volume": 116.76879913850283,
"volume_molar": 7.813312719869232,
"formula_full": "V3 Fe3 As3",
"formula_reduced": "VFeAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.894360483333333,
"spacegroup": 189
},
{
"id": "jvasp-90729",
"created_at": "2022-09-04T14:36:10.286293Z",
"updated_at": "2022-09-04T14:36:10.286310Z",
"structure_string": "U2 Fe2 As4\n1.0\n3.993301 -0.000000 -0.000000\n0.000000 3.993301 -0.000000\n-0.000000 -0.000000 8.719719\nU Fe As\n2 2 4\ndirect\n0.750000 0.750000 0.743014 U\n0.250000 0.250000 0.256986 U\n0.250000 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.250000 0.750000 0.000000 As\n0.750000 0.250000 0.000000 As\n0.750000 0.750000 0.343217 As\n0.250000 0.250000 0.656784 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"U",
"Fe",
"As"
],
"chemical_system": "As-Fe-U",
"density": 10.597872377981513,
"density_atomic": 0.05753384559705265,
"volume": 139.0485881307024,
"volume_molar": 10.467127127529439,
"formula_full": "U2 Fe2 As4",
"formula_reduced": "UFeAs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.3724587500000003,
"spacegroup": 129
},
{
"id": "jvasp-90136",
"created_at": "2022-09-04T14:35:46.466986Z",
"updated_at": "2022-09-04T14:35:46.467002Z",
"structure_string": "Ti3 Fe3 As3\n1.0\n0.000000 0.000000 -3.707128\n-3.090334 -5.352615 0.000000\n-3.090241 5.352561 0.000000\nTi Fe As\n3 3 3\ndirect\n0.500000 0.578995 -0.000001 Ti\n0.500000 0.420957 0.420961 Ti\n0.500000 -0.000005 0.579038 Ti\n0.000000 0.242456 -0.000000 Fe\n0.000000 0.757531 0.757532 Fe\n0.000000 -0.000002 0.242467 Fe\n0.000000 0.333328 0.666664 As\n0.000000 0.666664 0.333335 As\n0.500000 -0.000027 0.000000 As\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"Fe",
"As"
],
"chemical_system": "As-Fe-Ti",
"density": 7.256099413905966,
"density_atomic": 0.07338583343927918,
"volume": 122.63947383587009,
"volume_molar": 8.206135268577189,
"formula_full": "Ti3 Fe3 As3",
"formula_reduced": "TiFeAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6156585277777777,
"spacegroup": 189
},
{
"id": "jvasp-37044",
"created_at": "2022-09-04T14:35:46.584570Z",
"updated_at": "2022-09-04T14:35:46.584597Z",
"structure_string": "Ti1 Fe2 As1\n1.0\n2.901284 2.901284 0.000000\n2.901284 0.000000 -2.901284\n-0.000000 2.901284 -2.901284\nTi Fe As\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 Fe\n0.749999 0.749999 0.749999 Fe\n0.499999 0.499999 0.499999 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Fe",
"As"
],
"chemical_system": "As-Fe-Ti",
"density": 7.971711725816822,
"density_atomic": 0.08189535442057662,
"volume": 48.842819330848144,
"volume_molar": 7.353458328140413,
"formula_full": "Ti1 Fe2 As1",
"formula_reduced": "TiFe2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.164732770833333,
"spacegroup": 225
},
{
"id": "jvasp-62988",
"created_at": "2022-09-04T14:35:47.316060Z",
"updated_at": "2022-09-04T14:35:47.316083Z",
"structure_string": "Fe4 Te4 As4\n1.0\n0.000000 6.264046 -0.019108\n6.144869 0.000000 0.000000\n0.000000 -2.617271 -5.722200\nFe Te As\n4 4 4\ndirect\n0.285063 0.990844 0.291713 Fe\n0.714938 0.490844 0.208288 Fe\n0.714938 0.009156 0.708288 Fe\n0.285063 0.509156 0.791713 Fe\n0.152542 0.369994 0.365417 Te\n0.847459 0.869994 0.134583 Te\n0.847459 0.630006 0.634583 Te\n0.152542 0.130006 0.865417 Te\n0.357674 0.650198 0.160645 As\n0.642327 0.150198 0.339355 As\n0.642327 0.349802 0.839355 As\n0.357674 0.849802 0.660645 As\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"Te",
"As"
],
"chemical_system": "As-Fe-Te",
"density": 7.780532842042251,
"density_atomic": 0.05440579081673893,
"volume": 220.5647564322874,
"volume_molar": 11.06893341608625,
"formula_full": "Fe4 Te4 As4",
"formula_reduced": "FeTeAs",
"formula_anonymous": "ABC",
"energy_above_hull": 1.887175005555556,
"spacegroup": 14
},
{
"id": "jvasp-75642",
"created_at": "2022-09-04T14:35:42.927343Z",
"updated_at": "2022-09-04T14:35:42.927368Z",
"structure_string": "Ta2 Fe1 As1\n1.0\n0.000000 3.158408 3.158408\n3.158408 -0.000000 3.158408\n3.158408 3.158408 -0.000000\nTa Fe As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Ta\n0.750000 0.750000 0.750000 Fe\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Fe",
"As"
],
"chemical_system": "As-Fe-Ta",
"density": 12.982663229805468,
"density_atomic": 0.06347830220809503,
"volume": 63.01365759416771,
"volume_molar": 9.486927895863023,
"formula_full": "Ta2 Fe1 As1",
"formula_reduced": "Ta2FeAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.8692114125,
"spacegroup": 216
},
{
"id": "jvasp-14157",
"created_at": "2022-09-04T14:36:07.397379Z",
"updated_at": "2022-09-04T14:36:07.397417Z",
"structure_string": "Sr1 Fe2 As2\n1.0\n3.785058 -0.000000 -1.140914\n-0.343900 3.769403 -1.140914\n-0.114877 -0.125835 6.467938\nSr Fe As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750000 0.250000 0.500001 Fe\n0.250000 0.750000 0.500001 Fe\n0.646205 0.646205 0.292411 As\n0.353795 0.353796 0.707591 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"As"
],
"chemical_system": "As-Fe-Sr",
"density": 6.357689881455641,
"density_atomic": 0.05482822925263856,
"volume": 91.19389898515425,
"volume_molar": 10.983649922836403,
"formula_full": "Sr1 Fe2 As2",
"formula_reduced": "Sr(FeAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.213168162,
"spacegroup": 139
},
{
"id": "jvasp-97036",
"created_at": "2022-09-04T14:36:52.831164Z",
"updated_at": "2022-09-04T14:36:52.831192Z",
"structure_string": "Sr2 Fe4 As4\n1.0\n3.953274 -0.000000 0.000000\n0.000000 3.953274 0.000000\n0.000000 -0.000000 11.674296\nSr Fe As\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.499999 0.499999 0.500000 Sr\n0.499999 0.000000 0.250000 Fe\n0.000000 0.499999 0.750000 Fe\n0.000000 0.499999 0.250000 Fe\n0.499999 0.000000 0.750000 Fe\n0.000000 0.000000 0.646231 As\n0.499999 0.499999 0.146231 As\n0.000000 0.000000 0.353769 As\n0.499999 0.499999 0.853769 As\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"As"
],
"chemical_system": "As-Fe-Sr",
"density": 6.355512641580401,
"density_atomic": 0.05480945290317147,
"volume": 182.45027947398768,
"volume_molar": 10.987412646936924,
"formula_full": "Sr2 Fe4 As4",
"formula_reduced": "Sr(FeAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.213170162,
"spacegroup": 139
},
{
"id": "jvasp-15396",
"created_at": "2022-09-04T14:36:11.484170Z",
"updated_at": "2022-09-04T14:36:11.484195Z",
"structure_string": "Sr1 Fe2 As2\n1.0\n3.785058 -0.000000 -1.140914\n-0.343900 3.769403 -1.140914\n-0.114876 -0.125834 6.467940\nSr Fe As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750000 0.250000 0.500001 Fe\n0.250000 0.750000 0.500001 Fe\n0.646205 0.646205 0.292411 As\n0.353795 0.353795 0.707590 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"As"
],
"chemical_system": "As-Fe-Sr",
"density": 6.357687263881433,
"density_atomic": 0.054828206678879624,
"volume": 91.19393653132285,
"volume_molar": 10.983654445002648,
"formula_full": "Sr1 Fe2 As2",
"formula_reduced": "Sr(FeAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.213168162,
"spacegroup": 139
},
{
"id": "jvasp-75707",
"created_at": "2022-09-04T14:35:56.587696Z",
"updated_at": "2022-09-04T14:35:56.587726Z",
"structure_string": "Fe2 As1 Se1\n1.0\n0.000000 3.152462 3.152462\n3.152462 0.000000 3.152462\n3.152462 3.152462 0.000000\nFe As Se\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Fe\n0.500000 0.500000 0.500000 As\n0.750000 0.750000 0.750000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Fe",
"As",
"Se"
],
"chemical_system": "As-Fe-Se",
"density": 7.038030606261272,
"density_atomic": 0.06383816793473479,
"volume": 62.65843976113814,
"volume_molar": 9.433448601088866,
"formula_full": "Fe2 As1 Se1",
"formula_reduced": "Fe2AsSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7916615291666664,
"spacegroup": 216
},
{
"id": "jvasp-75858",
"created_at": "2022-09-04T14:36:09.347470Z",
"updated_at": "2022-09-04T14:36:09.347500Z",
"structure_string": "Sc2 Fe1 As1\n1.0\n-0.000000 3.154637 3.154637\n3.154637 -0.000000 3.154637\n3.154637 3.154637 -0.000000\nSc Fe As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750001 0.750001 0.750001 Sc\n0.250000 0.250000 0.250000 Fe\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Fe",
"As"
],
"chemical_system": "As-Fe-Sc",
"density": 5.836208479911633,
"density_atomic": 0.06370621712049086,
"volume": 62.78822037784151,
"volume_molar": 9.45298752963155,
"formula_full": "Sc2 Fe1 As1",
"formula_reduced": "Sc2FeAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6808819375,
"spacegroup": 216
},
{
"id": "jvasp-38025",
"created_at": "2022-09-04T14:38:10.695746Z",
"updated_at": "2022-09-04T14:38:10.695775Z",
"structure_string": "Fe2 Sb2 As2\n1.0\n3.087677 0.000000 0.000000\n0.000000 5.548493 0.000000\n0.000000 0.000000 6.280427\nFe Sb As\n2 2 2\ndirect\n0.000000 0.274292 0.692240 Fe\n0.500001 0.725708 0.192240 Fe\n0.000000 0.068687 0.057556 Sb\n0.500001 0.931312 0.557556 Sb\n0.000000 0.443059 0.342604 As\n0.500001 0.556941 0.842605 As\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Sb",
"As"
],
"chemical_system": "As-Fe-Sb",
"density": 7.794533848920493,
"density_atomic": 0.05576416109788652,
"volume": 107.59598785083135,
"volume_molar": 10.799303067482604,
"formula_full": "Fe2 Sb2 As2",
"formula_reduced": "FeSbAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.14200445,
"spacegroup": 31
}
]
}