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=-density_atomic&page=3833",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=3831",
"results": [
{
"id": "jvasp-37228",
"created_at": "2022-09-04T14:37:54.258063Z",
"updated_at": "2022-09-04T14:37:54.258090Z",
"structure_string": "Sm1 Er1 Mg2\n1.0\n-0.000000 3.776224 3.776224\n3.776224 -0.000000 3.776224\n3.776224 3.776224 -0.000000\nSm Er Mg\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Sm\n0.250000 0.250000 0.250000 Er\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.499999 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Er",
"Mg"
],
"chemical_system": "Er-Mg-Sm",
"density": 5.6467503654696625,
"density_atomic": 0.037141270133377015,
"volume": 107.69690927735394,
"volume_molar": 16.214148677129383,
"formula_full": "Sm1 Er1 Mg2",
"formula_reduced": "SmErMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2789767437499999,
"spacegroup": 225
},
{
"id": "jvasp-29160",
"created_at": "2022-09-04T14:37:55.509979Z",
"updated_at": "2022-09-04T14:37:55.510004Z",
"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.290984 0.000000 0.000000\n-1.645492 2.850119 0.000059\n0.000000 0.000713 34.445938\nMo W Se S\n2 2 6 2\ndirect\n0.333335 0.666670 0.095120 Mo\n0.666691 0.333383 0.659670 Mo\n0.333348 0.666695 0.467127 W\n0.666621 0.333245 0.281001 W\n0.333343 0.666688 0.708569 Se\n0.666683 0.333366 0.046221 Se\n0.666692 0.333384 0.417902 Se\n0.666664 0.333329 0.144066 Se\n0.666671 0.333343 0.516366 Se\n0.333366 0.666734 0.610711 Se\n0.333280 0.666562 0.325788 S\n0.333298 0.666598 0.236209 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 5.640363074379696,
"density_atomic": 0.037141074727587604,
"volume": 323.0924276697533,
"volume_molar": 16.214233982644778,
"formula_full": "Mo2 W2 Se6 S2",
"formula_reduced": "MoWSe3S",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.5918959999999998,
"spacegroup": 156
},
{
"id": "jvasp-119433",
"created_at": "2022-09-04T14:38:49.641336Z",
"updated_at": "2022-09-04T14:38:49.641362Z",
"structure_string": "Tl4 Cl12\n1.0\n5.739173 -0.000000 0.000000\n0.000000 7.019576 0.000000\n-0.000000 -0.000000 10.693298\nTl Cl\n4 12\ndirect\n-0.135415 0.750000 0.188262 Tl\n0.635415 0.750000 0.688262 Tl\n0.135415 0.250000 0.811739 Tl\n0.364585 0.250000 0.311738 Tl\n0.004048 0.750000 -0.026782 Cl\n0.495952 0.750000 0.473218 Cl\n-0.004048 0.250000 0.026782 Cl\n0.504048 0.250000 0.526782 Cl\n-0.012409 0.010311 0.344057 Cl\n0.512409 0.489689 0.844057 Cl\n0.012409 0.510311 0.655943 Cl\n0.487590 -0.010311 0.155943 Cl\n0.012409 -0.010311 0.655943 Cl\n0.487590 0.510311 0.155943 Cl\n-0.012409 0.489689 0.344057 Cl\n0.512409 0.010311 0.844057 Cl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tl",
"Cl"
],
"chemical_system": "Cl-Tl",
"density": 4.791126064244969,
"density_atomic": 0.03714053164665246,
"volume": 430.79620270977216,
"volume_molar": 16.214471072448386,
"formula_full": "Tl4 Cl12",
"formula_reduced": "TlCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1201270337499999,
"spacegroup": 62
},
{
"id": "jvasp-85740",
"created_at": "2022-09-04T14:35:55.527992Z",
"updated_at": "2022-09-04T14:35:55.528029Z",
"structure_string": "Y10 Cu2 Pb6\n1.0\n9.164371 -0.000000 0.000000\n-4.582186 7.936578 0.000000\n0.000000 0.000000 6.663626\nY Cu Pb\n10 2 6\ndirect\n-0.000000 0.744805 0.750000 Y\n0.666667 0.333333 0.000000 Y\n0.255195 0.000000 0.250000 Y\n0.666667 0.333333 0.500000 Y\n-0.000000 0.255195 0.250000 Y\n0.744805 0.000000 0.750000 Y\n0.744804 0.744805 0.250000 Y\n0.333333 0.666667 0.000000 Y\n0.333333 0.666667 0.500000 Y\n0.255195 0.255195 0.750000 Y\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n-0.000000 0.388586 0.750000 Pb\n0.388586 0.000000 0.750000 Pb\n0.388586 0.388586 0.250000 Pb\n0.611414 0.611414 0.750000 Pb\n-0.000000 0.611414 0.250000 Pb\n0.611414 0.000000 0.250000 Pb\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Y",
"Cu",
"Pb"
],
"chemical_system": "Cu-Pb-Y",
"density": 7.740805260704776,
"density_atomic": 0.03713863519860244,
"volume": 484.67047600815863,
"volume_molar": 16.215299048540743,
"formula_full": "Y10 Cu2 Pb6",
"formula_reduced": "Y5CuPb3",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.8910389066666664,
"spacegroup": 193
},
{
"id": "jvasp-102263",
"created_at": "2022-09-04T14:37:12.539641Z",
"updated_at": "2022-09-04T14:37:12.539662Z",
"structure_string": "Rb2 Ag1 Mo1 Cl6\n1.0\n6.277150 -0.000000 3.624114\n2.092383 5.918153 3.624114\n-0.000000 -0.000000 7.248228\nRb Ag Mo Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Mo\n0.760677 0.239323 0.239322 Cl\n0.239323 0.239323 0.760677 Cl\n0.239323 0.760677 0.760677 Cl\n0.239323 0.760677 0.239323 Cl\n0.760677 0.239323 0.760677 Cl\n0.760677 0.760677 0.239322 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Mo",
"Cl"
],
"chemical_system": "Ag-Cl-Mo-Rb",
"density": 3.6228319376184333,
"density_atomic": 0.03713808095386168,
"volume": 269.26539398800526,
"volume_molar": 16.215541043926255,
"formula_full": "Rb2 Ag1 Mo1 Cl6",
"formula_reduced": "Rb2AgMoCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.3993327565,
"spacegroup": 225
},
{
"id": "jvasp-35013",
"created_at": "2022-09-04T14:37:33.018791Z",
"updated_at": "2022-09-04T14:37:33.018809Z",
"structure_string": "Nd2 Tl2 Cd2\n1.0\n5.021220 -0.000000 0.000000\n-2.510609 4.348548 -0.000000\n-0.000000 -0.000000 7.399164\nNd Tl Cd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Nd\n0.000000 0.000000 0.000000 Nd\n0.333332 0.666665 0.750000 Tl\n0.666668 0.333335 0.250000 Tl\n0.333339 0.666678 0.250000 Cd\n0.666661 0.333323 0.750000 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Tl",
"Cd"
],
"chemical_system": "Cd-Nd-Tl",
"density": 9.477156288441051,
"density_atomic": 0.037137706419148105,
"volume": 161.56086572181033,
"volume_molar": 16.215704578070014,
"formula_full": "Nd2 Tl2 Cd2",
"formula_reduced": "NdTlCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-105503",
"created_at": "2022-09-04T14:36:48.661201Z",
"updated_at": "2022-09-04T14:36:48.661221Z",
"structure_string": "Ga2 Ag2 Te1 Se3\n1.0\n6.468860 0.000764 2.990757\n3.611740 5.366701 2.990757\n-0.014681 -0.007817 6.196890\nGa Ag Te Se\n2 2 1 3\ndirect\n0.742942 0.512431 0.613449 Ga\n0.487568 0.257058 0.386552 Ga\n0.271157 0.994674 0.127215 Ag\n0.005326 0.728843 0.872786 Ag\n0.857393 0.142607 0.000001 Te\n0.394702 0.605298 0.500001 Se\n0.120029 0.379112 0.281731 Se\n0.620888 0.879971 0.718271 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ga",
"Ag",
"Te",
"Se"
],
"chemical_system": "Ag-Ga-Se-Te",
"density": 5.547450204164471,
"density_atomic": 0.037136886406864224,
"volume": 215.41924415400948,
"volume_molar": 16.216062633853152,
"formula_full": "Ga2 Ag2 Te1 Se3",
"formula_reduced": "Ga2Ag2TeSe3",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 0.4853858795833333,
"spacegroup": 5
},
{
"id": "jvasp-16624",
"created_at": "2022-09-04T14:38:17.999105Z",
"updated_at": "2022-09-04T14:38:17.999125Z",
"structure_string": "Y1 Tl1\n1.0\n3.776442 -0.000000 0.000000\n-0.000000 3.776442 0.000000\n-0.000000 0.000000 3.776442\nY Tl\n1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Tl"
],
"chemical_system": "Tl-Y",
"density": 9.042669065857456,
"density_atomic": 0.037134838421066865,
"volume": 53.85778113054574,
"volume_molar": 16.21695694947092,
"formula_full": "Y1 Tl1",
"formula_reduced": "YTl",
"formula_anonymous": "AB",
"energy_above_hull": 0.553709025,
"spacegroup": 221
},
{
"id": "jvasp-71010",
"created_at": "2022-09-04T14:36:06.425441Z",
"updated_at": "2022-09-04T14:36:06.425466Z",
"structure_string": "Be1 Sb2 Br1\n1.0\n3.482909 -0.000000 0.000000\n-0.000000 3.482909 -0.000000\n0.000000 -0.000000 8.879889\nBe Sb Br\n1 2 1\ndirect\n0.000000 0.000000 0.328925 Be\n0.000000 0.000000 0.055281 Sb\n0.500000 0.500000 0.414291 Sb\n0.500000 0.500000 0.701502 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sb",
"Br"
],
"chemical_system": "Be-Br-Sb",
"density": 5.124666302517187,
"density_atomic": 0.03713369783852505,
"volume": 107.71887080553893,
"volume_molar": 16.217455062480248,
"formula_full": "Be1 Sb2 Br1",
"formula_reduced": "BeSb2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.28551310125,
"spacegroup": 99
},
{
"id": "jvasp-110932",
"created_at": "2022-09-04T14:38:38.467056Z",
"updated_at": "2022-09-04T14:38:38.467078Z",
"structure_string": "Nd3 Mg3 In3\n1.0\n7.682614 0.000000 0.000000\n-3.841307 6.653339 0.000000\n-0.000000 -0.000000 4.741663\nNd Mg In\n3 3 3\ndirect\n0.571109 -0.000000 -0.000000 Nd\n-0.000000 0.571109 -0.000000 Nd\n0.428890 0.428891 -0.000000 Nd\n0.242068 -0.000000 0.500000 Mg\n-0.000000 0.242069 0.500000 Mg\n0.757931 0.757932 0.500000 Mg\n0.333333 0.666667 0.500000 In\n0.666666 0.333333 0.500000 In\n0.000000 0.000000 0.000000 In\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"In"
],
"chemical_system": "In-Mg-Nd",
"density": 5.824212462292756,
"density_atomic": 0.03713326692731362,
"volume": 242.370271853996,
"volume_molar": 16.217643257158112,
"formula_full": "Nd3 Mg3 In3",
"formula_reduced": "NdMgIn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-106720",
"created_at": "2022-09-04T14:37:02.030369Z",
"updated_at": "2022-09-04T14:37:02.030384Z",
"structure_string": "Th2 In3 Sn3\n1.0\n4.758204 -0.000000 0.000000\n0.000000 4.828293 0.000000\n0.000000 -0.000000 9.378129\nTh In Sn\n2 3 3\ndirect\n0.000000 0.000000 0.245844 Th\n0.000000 0.000000 0.754156 Th\n0.500000 0.500000 0.254842 In\n0.500000 0.500000 0.745158 In\n-0.000000 0.500000 0.500000 In\n-0.000000 0.500000 -0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.000000 -0.000000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Th",
"In",
"Sn"
],
"chemical_system": "In-Sn-Th",
"density": 8.976260033041918,
"density_atomic": 0.03713103969664309,
"volume": 215.4531643972053,
"volume_molar": 16.218616039842388,
"formula_full": "Th2 In3 Sn3",
"formula_reduced": "Th2(InSn)3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.8952170262500001,
"spacegroup": 47
},
{
"id": "jvasp-14531",
"created_at": "2022-09-04T14:38:11.592505Z",
"updated_at": "2022-09-04T14:38:11.592529Z",
"structure_string": "Nd2 Mg4\n1.0\n5.294735 -0.000000 3.056917\n1.764912 4.991923 3.056917\n-0.000000 -0.000000 6.113833\nNd Mg\n2 4\ndirect\n0.875001 0.874999 0.875000 Nd\n0.125000 0.125000 0.125000 Nd\n0.500000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n-0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"Mg"
],
"chemical_system": "Mg-Nd",
"density": 3.963488131702448,
"density_atomic": 0.037130053260453724,
"volume": 161.59416626505214,
"volume_molar": 16.219046920716455,
"formula_full": "Nd2 Mg4",
"formula_reduced": "NdMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1779835,
"spacegroup": 227
}
]
}