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=590",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=588",
"results": [
{
"id": "jvasp-16803",
"created_at": "2022-09-04T14:38:31.778534Z",
"updated_at": "2022-09-04T14:38:31.778567Z",
"structure_string": "Mn1 Au1\n1.0\n3.204276 0.000000 -0.000000\n-0.000000 3.204276 -0.000000\n0.000000 -0.000000 3.204276\nMn Au\n1 1\ndirect\n0.500001 0.500001 0.500001 Mn\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Au"
],
"chemical_system": "Au-Mn",
"density": 12.714388248035212,
"density_atomic": 0.06079113400711116,
"volume": 32.89953432627274,
"volume_molar": 9.906281332563312,
"formula_full": "Mn1 Au1",
"formula_reduced": "MnAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.592652405689655,
"spacegroup": 221
},
{
"id": "jvasp-111837",
"created_at": "2022-09-04T14:38:42.283593Z",
"updated_at": "2022-09-04T14:38:42.283619Z",
"structure_string": "Eu4 S8\n1.0\n3.957558 0.000000 0.000000\n0.000000 7.917352 0.004260\n0.000000 -0.000029 7.992918\nEu S\n4 8\ndirect\n0.286437 0.871035 0.275157 Eu\n0.786437 0.628965 0.724843 Eu\n0.713563 0.128965 0.724843 Eu\n0.213563 0.371035 0.275157 Eu\n0.836739 0.889380 0.002717 S\n0.336739 0.610619 0.997284 S\n0.163262 0.110620 0.997284 S\n0.663262 0.389380 0.002717 S\n0.260005 0.874696 0.631928 S\n0.760006 0.625304 0.368073 S\n0.739995 0.125304 0.368073 S\n0.239995 0.374696 0.631928 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Eu",
"S"
],
"chemical_system": "Eu-S",
"density": 5.731115973034001,
"density_atomic": 0.04791468589607616,
"volume": 250.44513546488062,
"volume_molar": 12.568465486889826,
"formula_full": "Eu4 S8",
"formula_reduced": "EuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9288033333333336,
"spacegroup": 14
},
{
"id": "jvasp-115898",
"created_at": "2022-09-04T14:38:39.823439Z",
"updated_at": "2022-09-04T14:38:39.823472Z",
"structure_string": "P2 Cl1\n1.0\n5.243183 -0.997187 0.197670\n2.232619 -2.586706 -0.151246\n2.004435 -1.861430 -5.942931\nP Cl\n2 1\ndirect\n0.418462 0.786118 0.324720 P\n0.823722 0.657605 0.452969 P\n0.357237 0.144251 0.968517 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"P",
"Cl"
],
"chemical_system": "Cl-P",
"density": 2.435802337247365,
"density_atomic": 0.04518069495245167,
"volume": 66.40004106083829,
"volume_molar": 13.32901312460493,
"formula_full": "P2 Cl1",
"formula_reduced": "P2Cl",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7588383558333334,
"spacegroup": 8
},
{
"id": "jvasp-29221",
"created_at": "2022-09-04T14:38:34.690922Z",
"updated_at": "2022-09-04T14:38:34.690945Z",
"structure_string": "Re6 Cl18\n1.0\n8.404159 -0.069715 3.093833\n2.134552 8.128865 3.093833\n-0.091164 -0.069715 8.955076\nRe Cl\n6 18\ndirect\n0.647638 0.884836 0.647638 Re\n0.884837 0.647637 0.647638 Re\n0.115164 0.352362 0.352362 Re\n0.352362 0.115163 0.352362 Re\n0.352362 0.352362 0.115164 Re\n0.647639 0.647637 0.884836 Re\n0.267980 0.267979 0.951292 Cl\n0.267980 0.951292 0.267980 Cl\n0.951293 0.267979 0.267980 Cl\n0.048708 0.732020 0.732020 Cl\n0.732020 0.732020 0.048707 Cl\n0.732021 0.048707 0.732020 Cl\n0.119303 0.119303 0.589332 Cl\n0.178694 0.495985 0.495985 Cl\n0.821306 0.504014 0.504015 Cl\n0.504015 0.504014 0.821306 Cl\n0.504015 0.821306 0.504014 Cl\n0.880698 0.410668 0.880697 Cl\n0.880697 0.880697 0.410668 Cl\n0.410669 0.880697 0.880697 Cl\n0.589332 0.119303 0.119303 Cl\n0.119303 0.589332 0.119303 Cl\n0.495986 0.178693 0.495985 Cl\n0.495985 0.495985 0.178694 Cl\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Re",
"Cl"
],
"chemical_system": "Cl-Re",
"density": 4.726042953897101,
"density_atomic": 0.03891210313708362,
"volume": 616.7746810150635,
"volume_molar": 15.47626644282005,
"formula_full": "Re6 Cl18",
"formula_reduced": "ReCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6353000506250002,
"spacegroup": 166
},
{
"id": "jvasp-19618",
"created_at": "2022-09-04T14:38:32.197866Z",
"updated_at": "2022-09-04T14:38:32.197888Z",
"structure_string": "Pr2 Al4\n1.0\n4.966797 -0.000000 2.867581\n1.655599 4.682741 2.867581\n0.000000 -0.000000 5.735163\nPr Al\n2 4\ndirect\n0.125000 0.125000 0.125000 Pr\n0.875001 0.875000 0.874999 Pr\n0.500000 0.000000 0.499999 Al\n0.000000 0.500000 0.500000 Al\n0.500001 0.500000 0.499999 Al\n0.500001 0.500000 -0.000000 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Al"
],
"chemical_system": "Al-Pr",
"density": 4.851805532785604,
"density_atomic": 0.044980982452061544,
"volume": 133.38970544706302,
"volume_molar": 13.388193035619205,
"formula_full": "Pr2 Al4",
"formula_reduced": "PrAl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3278718166666668,
"spacegroup": 227
},
{
"id": "jvasp-19651",
"created_at": "2022-09-04T14:38:31.252804Z",
"updated_at": "2022-09-04T14:38:31.252821Z",
"structure_string": "Co2 S2\n1.0\n1.679052 -2.908202 0.000000\n1.679052 2.908202 0.000000\n0.000000 -0.000000 5.155706\nCo S\n2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.333333 0.666666 0.250000 S\n0.666666 0.333333 0.750001 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"S"
],
"chemical_system": "Co-S",
"density": 6.00212472862299,
"density_atomic": 0.07944254276106379,
"volume": 50.35085561184317,
"volume_molar": 7.580498497023888,
"formula_full": "Co2 S2",
"formula_reduced": "CoS",
"formula_anonymous": "AB",
"energy_above_hull": 1.5474404500000003,
"spacegroup": 194
},
{
"id": "jvasp-19686",
"created_at": "2022-09-04T14:38:32.248954Z",
"updated_at": "2022-09-04T14:38:32.248985Z",
"structure_string": "Zn6 Ru2\n1.0\n3.683910 0.000000 -0.867719\n-0.204385 3.678236 -0.867719\n0.001493 0.001578 8.260230\nZn Ru\n6 2\ndirect\n0.629090 0.629091 0.258180 Zn\n0.370908 0.370910 0.741820 Zn\n0.500000 -0.000000 -0.000000 Zn\n-0.000001 0.500001 -0.000000 Zn\n0.749999 0.250001 0.500000 Zn\n0.249999 0.750001 0.500000 Zn\n0.882668 0.882671 0.765339 Ru\n0.117330 0.117330 0.234661 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zn",
"Ru"
],
"chemical_system": "Ru-Zn",
"density": 8.82042947702015,
"density_atomic": 0.07146774826873453,
"volume": 111.938604388629,
"volume_molar": 8.426375401328471,
"formula_full": "Zn6 Ru2",
"formula_reduced": "Zn3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-110527",
"created_at": "2022-09-04T14:38:39.434640Z",
"updated_at": "2022-09-04T14:38:39.434652Z",
"structure_string": "Tl1 In3\n1.0\n3.345444 0.000000 -0.000000\n0.000000 3.345444 -0.000000\n-0.000000 -0.000000 10.128128\nTl In\n1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.499999 0.742427 In\n0.000000 0.000000 0.500000 In\n0.499999 0.499999 0.257573 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"In"
],
"chemical_system": "In-Tl",
"density": 8.039999212107853,
"density_atomic": 0.035287694172633534,
"volume": 113.35396357810473,
"volume_molar": 17.065838109281497,
"formula_full": "Tl1 In3",
"formula_reduced": "TlIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0014675,
"spacegroup": 123
},
{
"id": "jvasp-116268",
"created_at": "2022-09-04T14:38:41.467088Z",
"updated_at": "2022-09-04T14:38:41.467114Z",
"structure_string": "Li2 H2\n1.0\n3.147277 0.721929 0.307936\n-0.936832 -3.095015 -0.255251\n-0.592670 -2.864536 -4.313323\nLi H\n2 2\ndirect\n0.971297 0.937148 0.053156 Li\n0.638078 0.770553 0.553142 Li\n0.971423 0.437211 0.553116 H\n0.637957 0.270550 0.053141 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.7102662513644956,
"density_atomic": 0.10761996805291489,
"volume": 37.16782370752302,
"volume_molar": 5.5957466527392175,
"formula_full": "Li2 H2",
"formula_reduced": "LiH",
"formula_anonymous": "AB",
"energy_above_hull": 0.8284849999999999,
"spacegroup": 194
},
{
"id": "jvasp-29663",
"created_at": "2022-09-04T14:38:31.364418Z",
"updated_at": "2022-09-04T14:38:31.364452Z",
"structure_string": "Er6 I7\n1.0\n3.897859 -0.000000 0.686500\n1.263222 10.123584 4.236619\n0.017402 0.130040 11.310233\nEr I\n6 7\ndirect\n0.870563 0.712341 0.546533 Er\n0.685818 0.006792 0.621570 Er\n0.237318 0.728670 0.796693 Er\n0.314181 0.993208 0.378430 Er\n0.762681 0.271330 0.203308 Er\n0.129437 0.287660 0.453467 Er\n0.387355 0.160248 0.065041 I\n0.833879 0.500473 0.831766 I\n0.166120 0.499526 0.168233 I\n0.612644 0.839752 0.934959 I\n0.953023 0.834364 0.259591 I\n0.500000 0.500000 0.500000 I\n0.046977 0.165635 0.740409 I\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Er",
"I"
],
"chemical_system": "Er-I",
"density": 7.073178510666557,
"density_atomic": 0.02926941707683013,
"volume": 444.1496038638531,
"volume_molar": 20.57485717666433,
"formula_full": "Er6 I7",
"formula_reduced": "Er6I7",
"formula_anonymous": "A6B7",
"energy_above_hull": 0.6525430769230771,
"spacegroup": 12
},
{
"id": "jvasp-110748",
"created_at": "2022-09-04T14:38:39.794991Z",
"updated_at": "2022-09-04T14:38:39.795011Z",
"structure_string": "Ba3 Sb1\n1.0\n5.489209 -0.000000 0.000000\n0.000000 5.489209 0.000000\n-0.000000 -0.000000 5.489209\nBa Sb\n3 1\ndirect\n-0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 -0.000000 Ba\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Sb"
],
"chemical_system": "Ba-Sb",
"density": 5.358587938986683,
"density_atomic": 0.02418414238708885,
"volume": 165.39763684717113,
"volume_molar": 24.901196261625678,
"formula_full": "Ba3 Sb1",
"formula_reduced": "Ba3Sb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0656485025,
"spacegroup": 221
},
{
"id": "jvasp-114995",
"created_at": "2022-09-04T14:38:41.499395Z",
"updated_at": "2022-09-04T14:38:41.499423Z",
"structure_string": "Ge1 F2\n1.0\n4.010568 0.000000 0.010949\n0.000000 2.604788 0.000000\n-0.010482 0.000000 3.855274\nGe F\n1 2\ndirect\n0.633350 0.000000 -0.033467 Ge\n-0.366700 0.000000 -0.533384 F\n0.133350 0.000000 -0.033148 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"F"
],
"chemical_system": "F-Ge",
"density": 4.561545264895318,
"density_atomic": 0.07448769149704297,
"volume": 40.275110420345015,
"volume_molar": 8.084746135862014,
"formula_full": "Ge1 F2",
"formula_reduced": "GeF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1109599999999999,
"spacegroup": 47
}
]
}