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=nelements&page=384",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=382",
"results": [
{
"id": "jvasp-104917",
"created_at": "2022-09-04T14:36:53.833116Z",
"updated_at": "2022-09-04T14:36:53.833139Z",
"structure_string": "Ti3 Al5\n1.0\n3.911161 -0.000000 0.000000\n0.000000 4.032188 0.000000\n-0.000000 -0.000000 8.109202\nTi Al\n3 5\ndirect\n-0.000000 0.500000 0.264983 Ti\n-0.000000 0.500000 0.735017 Ti\n0.500000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 0.241001 Al\n0.500000 0.000000 0.758999 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"Al"
],
"chemical_system": "Al-Ti",
"density": 3.6162901406142423,
"density_atomic": 0.06255548587362796,
"volume": 127.88646572358616,
"volume_molar": 9.626878723579388,
"formula_full": "Ti3 Al5",
"formula_reduced": "Ti3Al5",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.848689875,
"spacegroup": 47
},
{
"id": "jvasp-9116",
"created_at": "2022-09-04T14:37:02.309987Z",
"updated_at": "2022-09-04T14:37:02.310008Z",
"structure_string": "Be8 Fe4\n1.0\n2.084460 -3.610389 -0.000000\n2.084460 3.610389 0.000000\n-0.000000 0.000000 6.788122\nBe Fe\n8 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.000000 0.000000 0.500000 Be\n0.829773 0.170227 0.750000 Be\n0.170227 0.340454 0.250000 Be\n0.659547 0.829773 0.250000 Be\n0.340454 0.170227 0.750000 Be\n0.829773 0.659547 0.750000 Be\n0.170227 0.829773 0.250000 Be\n0.333333 0.666667 0.938384 Fe\n0.666667 0.333333 0.438384 Fe\n0.666667 0.333333 0.061616 Fe\n0.333333 0.666667 0.561615 Fe\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Be",
"Fe"
],
"chemical_system": "Be-Fe",
"density": 4.802266428766083,
"density_atomic": 0.117450277808183,
"volume": 102.17089498586044,
"volume_molar": 5.127395926500249,
"formula_full": "Be8 Fe4",
"formula_reduced": "Be2Fe",
"formula_anonymous": "AB2",
"energy_above_hull": 2.013342566666667,
"spacegroup": 194
},
{
"id": "jvasp-97028",
"created_at": "2022-09-04T14:36:43.437866Z",
"updated_at": "2022-09-04T14:36:43.437895Z",
"structure_string": "Fe2 Te2\n1.0\n3.651927 0.000000 0.000000\n-0.000000 3.651927 0.000000\n0.000000 -0.000000 6.573512\nFe Te\n2 2\ndirect\n0.250000 0.750001 -0.000000 Fe\n0.750001 0.250000 -0.000000 Fe\n0.250000 0.250000 0.279914 Te\n0.750001 0.750001 0.720086 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"Te"
],
"chemical_system": "Fe-Te",
"density": 6.949336424566134,
"density_atomic": 0.045626626129678986,
"volume": 87.66810828026794,
"volume_molar": 13.198742205667378,
"formula_full": "Fe2 Te2",
"formula_reduced": "FeTe",
"formula_anonymous": "AB",
"energy_above_hull": 1.4331216333333332,
"spacegroup": 129
},
{
"id": "jvasp-78478",
"created_at": "2022-09-04T14:37:02.271428Z",
"updated_at": "2022-09-04T14:37:02.271453Z",
"structure_string": "Mg1 Nb2\n1.0\n2.181056 1.715836 -0.666448\n2.181056 -1.715836 -0.666448\n0.049841 0.000000 -7.633063\nMg Nb\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.327572 0.327572 0.344659 Nb\n0.672430 0.672430 0.655341 Nb\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Nb"
],
"chemical_system": "Mg-Nb",
"density": 6.119385272071893,
"density_atomic": 0.05261592283178209,
"volume": 57.016960618390634,
"volume_molar": 11.44547208504417,
"formula_full": "Mg1 Nb2",
"formula_reduced": "MgNb2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.062467247619047,
"spacegroup": 69
},
{
"id": "jvasp-107525",
"created_at": "2022-09-04T14:36:55.458663Z",
"updated_at": "2022-09-04T14:36:55.458685Z",
"structure_string": "Sn1 Sb1\n1.0\n4.105312 -0.092418 1.420612\n0.982207 3.987154 1.420612\n-0.120721 -0.092418 4.342482\nSn Sb\n1 1\ndirect\n0.347405 0.347404 0.347405 Sn\n0.652596 0.652594 0.652595 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 5.501361611339383,
"density_atomic": 0.027554351067987846,
"volume": 72.58381789014673,
"volume_molar": 21.85549841163349,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.7350539000000003,
"spacegroup": 160
},
{
"id": "jvasp-103226",
"created_at": "2022-09-04T14:36:55.412382Z",
"updated_at": "2022-09-04T14:36:55.412409Z",
"structure_string": "Ag1 Hg3\n1.0\n4.495178 -0.000000 0.000000\n0.000000 4.495178 -0.000000\n-0.000000 0.000000 4.495178\nAg Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Hg"
],
"chemical_system": "Ag-Hg",
"density": 12.973148886617663,
"density_atomic": 0.04403716075185782,
"volume": 90.8323772856144,
"volume_molar": 13.675134039484915,
"formula_full": "Ag1 Hg3",
"formula_reduced": "AgHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-8566",
"created_at": "2022-09-04T14:37:02.764570Z",
"updated_at": "2022-09-04T14:37:02.764591Z",
"structure_string": "Ag1 I1\n1.0\n3.744033 -0.000000 2.161618\n1.248011 3.529908 2.161618\n0.000000 -0.000000 4.323237\nAg I\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.499999 0.500000 0.500001 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"I"
],
"chemical_system": "Ag-I",
"density": 6.823144013190783,
"density_atomic": 0.035004017876004045,
"volume": 57.1362980982546,
"volume_molar": 17.204141482650474,
"formula_full": "Ag1 I1",
"formula_reduced": "AgI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0079499999999999,
"spacegroup": 225
},
{
"id": "jvasp-106621",
"created_at": "2022-09-04T14:36:53.797174Z",
"updated_at": "2022-09-04T14:36:53.797185Z",
"structure_string": "Y3 Ga1\n1.0\n4.707209 -0.000000 0.000000\n0.000000 4.707209 0.000000\n-0.000000 -0.000000 4.707209\nY Ga\n3 1\ndirect\n-0.000000 0.500000 0.500000 Y\n0.500000 0.000000 0.500000 Y\n0.500000 0.500000 -0.000000 Y\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Y",
"Ga"
],
"chemical_system": "Ga-Y",
"density": 5.356325828418349,
"density_atomic": 0.03835036901028259,
"volume": 104.30147357715151,
"volume_molar": 15.702953883925678,
"formula_full": "Y3 Ga1",
"formula_reduced": "Y3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 1.99970966875,
"spacegroup": 221
},
{
"id": "jvasp-79491",
"created_at": "2022-09-04T14:36:44.640076Z",
"updated_at": "2022-09-04T14:36:44.640099Z",
"structure_string": "H3 S1\n1.0\n-0.223393 -0.128975 -3.657102\n0.216869 -3.470636 1.082455\n-2.897225 1.923133 1.082454\nH S\n3 1\ndirect\n0.306444 0.646637 0.957852 H\n0.306443 0.957855 0.646634 H\n0.576223 0.436934 0.436932 H\n0.619686 0.958587 0.958583 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 1.5753317846546708,
"density_atomic": 0.10814692262858536,
"volume": 36.9867204981635,
"volume_molar": 5.568480927267948,
"formula_full": "H3 S1",
"formula_reduced": "H3S",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4980225,
"spacegroup": 42
},
{
"id": "jvasp-52391",
"created_at": "2022-09-04T14:37:02.834650Z",
"updated_at": "2022-09-04T14:37:02.834667Z",
"structure_string": "W6 O18\n1.0\n7.456169 0.000000 0.000000\n3.728084 6.457232 -0.000000\n-0.000000 0.000000 7.666770\nW O\n6 18\ndirect\n0.500000 0.500000 0.000000 W\n0.500000 -0.000000 0.000000 W\n-0.000000 0.500000 0.000000 W\n0.500000 0.500000 0.500000 W\n0.500000 -0.000000 0.500000 W\n-0.000000 0.500000 0.500000 W\n-0.000000 0.500000 0.750000 O\n-0.000000 0.500000 0.250000 O\n0.500000 -0.000000 0.750000 O\n0.500000 -0.000000 0.250000 O\n0.785745 0.428508 0.500000 O\n0.785747 0.428506 0.000000 O\n0.214255 0.214255 0.500000 O\n0.214253 0.214253 0.000000 O\n0.428508 0.785745 0.500000 O\n0.785747 0.785747 0.000000 O\n0.500000 0.500000 0.250000 O\n0.428506 0.785747 0.000000 O\n0.214254 0.571491 0.500000 O\n0.214252 0.571493 0.000000 O\n0.571491 0.214255 0.500000 O\n0.571493 0.214253 0.000000 O\n0.785745 0.785745 0.500000 O\n0.500000 0.500000 0.750000 O\n",
"nsites": 24,
"nelements": 2,
"elements": [
"W",
"O"
],
"chemical_system": "O-W",
"density": 6.25764289899898,
"density_atomic": 0.065018459212691,
"volume": 369.125941934278,
"volume_molar": 9.262201585399204,
"formula_full": "W6 O18",
"formula_reduced": "WO3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.224262625,
"spacegroup": 191
},
{
"id": "jvasp-28386",
"created_at": "2022-09-04T14:36:55.411810Z",
"updated_at": "2022-09-04T14:36:55.411835Z",
"structure_string": "Ta2 Se4\n1.0\n3.472666 0.000000 0.000000\n-1.736333 3.007070 0.000000\n-0.000000 0.000000 13.091310\nTa Se\n2 4\ndirect\n0.333361 0.666720 0.250000 Ta\n0.666641 0.333280 0.750000 Ta\n0.333288 0.666574 0.878204 Se\n0.666714 0.333426 0.121796 Se\n0.666714 0.333426 0.378204 Se\n0.333288 0.666574 0.621796 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.23227441629978,
"density_atomic": 0.043889596730474864,
"volume": 136.70665594960647,
"volume_molar": 13.721112082623694,
"formula_full": "Ta2 Se4",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5373353111111108,
"spacegroup": 194
},
{
"id": "jvasp-104694",
"created_at": "2022-09-04T14:36:53.865936Z",
"updated_at": "2022-09-04T14:36:53.865950Z",
"structure_string": "Sn1 Sb1\n1.0\n3.104069 0.000000 0.000000\n0.000000 3.104069 0.000000\n0.000000 0.000000 6.218092\nSn Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 6.66484608283656,
"density_atomic": 0.033381828309932006,
"volume": 59.91283585282072,
"volume_molar": 18.040176541823055,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.6876689000000002,
"spacegroup": 123
}
]
}