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=-id&page=3602",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=3600",
"results": [
{
"id": "jvasp-118041",
"created_at": "2022-09-04T14:38:49.495830Z",
"updated_at": "2022-09-04T14:38:49.495849Z",
"structure_string": "H1 Pb1 Cl1\n1.0\n4.903771 -0.000000 -0.000000\n-2.451886 4.246790 0.000000\n0.000000 0.000000 3.317022\nH Pb Cl\n1 1 1\ndirect\n0.333333 0.666667 0.000000 H\n0.666667 0.333334 0.000000 Pb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"Pb",
"Cl"
],
"chemical_system": "Cl-H-Pb",
"density": 5.857276066606007,
"density_atomic": 0.043429210634421206,
"volume": 69.07793064104771,
"volume_molar": 13.86656739099688,
"formula_full": "H1 Pb1 Cl1",
"formula_reduced": "HPbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9200716291666668,
"spacegroup": 187
},
{
"id": "jvasp-118040",
"created_at": "2022-09-04T14:38:50.601581Z",
"updated_at": "2022-09-04T14:38:50.601607Z",
"structure_string": "H1 Cl1 O1\n1.0\n4.355613 0.186734 0.000000\n-1.787786 3.368812 0.000000\n0.000000 0.000000 3.601161\nH Cl O\n1 1 1\ndirect\n-0.056434 0.393367 0.000000 H\n0.207296 0.018723 0.000000 Cl\n0.849136 0.587908 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"Cl",
"O"
],
"chemical_system": "Cl-H-O",
"density": 1.6119123074757566,
"density_atomic": 0.05551143670675788,
"volume": 54.04291760358608,
"volume_molar": 10.848468562995908,
"formula_full": "H1 Cl1 O1",
"formula_reduced": "HClO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4063558558333336,
"spacegroup": 6
},
{
"id": "jvasp-118038",
"created_at": "2022-09-04T14:38:30.829027Z",
"updated_at": "2022-09-04T14:38:30.829046Z",
"structure_string": "H3 Cl1 O1\n1.0\n3.252406 -0.000000 0.000000\n0.000000 3.252406 -0.000000\n0.000000 -0.000000 3.252406\nH Cl O\n3 1 1\ndirect\n0.500000 0.000000 0.000000 H\n0.000000 0.000000 0.500000 H\n0.000000 0.500000 0.000000 H\n0.500000 0.500000 0.500000 Cl\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"H",
"Cl",
"O"
],
"chemical_system": "Cl-H-O",
"density": 2.629310052492639,
"density_atomic": 0.14533015729859355,
"volume": 34.404421580078946,
"volume_molar": 4.143765390432341,
"formula_full": "H3 Cl1 O1",
"formula_reduced": "H3ClO",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.2852755135,
"spacegroup": 221
},
{
"id": "jvasp-118034",
"created_at": "2022-09-04T14:38:54.111577Z",
"updated_at": "2022-09-04T14:38:54.111600Z",
"structure_string": "Ni1 H1 Cl1\n1.0\n3.826567 0.000000 0.000000\n-1.913284 3.313905 -0.000000\n0.000000 -0.000000 3.230409\nNi H Cl\n1 1 1\ndirect\n0.666667 0.333332 0.000000 Ni\n0.333333 0.666665 0.000000 H\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ni",
"H",
"Cl"
],
"chemical_system": "Cl-H-Ni",
"density": 3.8571880360820203,
"density_atomic": 0.07323427170773662,
"volume": 40.96442731037733,
"volume_molar": 8.223118247196016,
"formula_full": "Ni1 H1 Cl1",
"formula_reduced": "NiHCl",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2810754891666667,
"spacegroup": 187
},
{
"id": "jvasp-118032",
"created_at": "2022-09-04T14:38:30.793945Z",
"updated_at": "2022-09-04T14:38:30.793973Z",
"structure_string": "Ni1 H1 Cl2\n1.0\n3.684287 0.000000 -0.000000\n0.000000 3.684287 0.000000\n0.000000 0.000000 4.539368\nNi H Cl\n1 1 2\ndirect\n0.500000 0.500000 0.550025 Ni\n0.000000 0.000000 0.850320 H\n0.000000 0.000000 0.560518 Cl\n0.500000 0.500000 0.049137 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ni",
"H",
"Cl"
],
"chemical_system": "Cl-H-Ni",
"density": 3.5197707900949844,
"density_atomic": 0.0649168879734125,
"volume": 61.61724822111388,
"volume_molar": 9.276693550785186,
"formula_full": "Ni1 H1 Cl2",
"formula_reduced": "NiHCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.92968013375,
"spacegroup": 99
},
{
"id": "jvasp-118031",
"created_at": "2022-09-04T14:38:49.573017Z",
"updated_at": "2022-09-04T14:38:49.573044Z",
"structure_string": "H4 N1 Cl1\n1.0\n1.509633 0.871587 5.389305\n-1.509633 0.871587 5.389305\n-0.000000 -1.743174 5.389305\nH N Cl\n4 1 1\ndirect\n0.935077 0.935077 0.935071 H\n0.064925 0.064925 0.064925 H\n0.664685 0.664685 0.664681 H\n0.335317 0.335317 0.335315 H\n0.000000 0.000000 0.000000 N\n0.500001 0.500001 0.499998 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 2.087696732474438,
"density_atomic": 0.1410214294935814,
"volume": 42.54672514345127,
"volume_molar": 4.270372794848246,
"formula_full": "H4 N1 Cl1",
"formula_reduced": "H4NCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.9685695529166662,
"spacegroup": 166
},
{
"id": "jvasp-118030",
"created_at": "2022-09-04T14:38:30.721559Z",
"updated_at": "2022-09-04T14:38:30.721591Z",
"structure_string": "H1 N1 Cl1\n1.0\n3.631006 0.000000 0.000000\n-1.815503 3.144543 0.000000\n-0.000000 -0.000000 3.220880\nH N Cl\n1 1 1\ndirect\n0.333334 0.666666 0.000000 H\n0.666667 0.333333 0.000000 N\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 2.2787833879739487,
"density_atomic": 0.08157596231171839,
"volume": 36.77553920279099,
"volume_molar": 7.3822491201368505,
"formula_full": "H1 N1 Cl1",
"formula_reduced": "HNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0285657724999995,
"spacegroup": 187
},
{
"id": "jvasp-11803",
"created_at": "2022-09-04T14:37:00.635571Z",
"updated_at": "2022-09-04T14:37:00.635596Z",
"structure_string": "Ba3 Mn2 O8\n1.0\n5.362059 0.004197 5.853876\n2.278615 4.853824 5.853876\n0.006602 0.004197 7.938482\nBa Mn O\n3 2 8\ndirect\n0.793087 0.793088 0.793089 Ba\n0.206912 0.206912 0.206913 Ba\n0.000000 0.000000 0.000000 Ba\n0.592602 0.592603 0.592604 Mn\n0.407397 0.407397 0.407398 Mn\n0.670784 0.670785 0.670786 O\n0.329214 0.329215 0.329215 O\n0.273258 0.757909 0.273259 O\n0.757909 0.273259 0.273259 O\n0.273258 0.273259 0.757909 O\n0.726741 0.726742 0.242092 O\n0.242090 0.726742 0.726743 O\n0.726741 0.242092 0.726742 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-O",
"density": 5.231473675801715,
"density_atomic": 0.06302366362275932,
"volume": 206.2717279943306,
"volume_molar": 9.555364467617625,
"formula_full": "Ba3 Mn2 O8",
"formula_reduced": "Ba3Mn2O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.3599592609814324,
"spacegroup": 166
},
{
"id": "jvasp-118029",
"created_at": "2022-09-04T14:38:49.130291Z",
"updated_at": "2022-09-04T14:38:49.130306Z",
"structure_string": "H4 N1 Cl1\n1.0\n3.805314 0.000000 0.000000\n-0.000000 3.805314 0.000000\n-0.000000 -0.000000 3.805314\nH N Cl\n4 1 1\ndirect\n0.157999 0.157999 0.842000 H\n0.157999 0.842000 0.157999 H\n0.842000 0.157999 0.157999 H\n0.842000 0.842000 0.842000 H\n0.000000 0.000000 0.000000 N\n0.499999 0.499999 0.499999 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 1.6119889203766744,
"density_atomic": 0.10888793297573308,
"volume": 55.102524550054305,
"volume_molar": 5.530585984529711,
"formula_full": "H4 N1 Cl1",
"formula_reduced": "H4NCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.77697788625,
"spacegroup": 215
},
{
"id": "jvasp-118028",
"created_at": "2022-09-04T14:38:30.636814Z",
"updated_at": "2022-09-04T14:38:30.636839Z",
"structure_string": "H1 N1 Cl1\n1.0\n3.505512 1.116637 0.000000\n1.953301 6.224372 0.000000\n0.000000 0.000000 3.673344\nH N Cl\n1 1 1\ndirect\n0.138213 -0.002562 0.000000 H\n0.037485 0.359589 0.000000 N\n0.024076 -0.157129 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 1.1616961911014112,
"density_atomic": 0.04158643827363152,
"volume": 72.13890211661126,
"volume_molar": 14.481020760603165,
"formula_full": "H1 N1 Cl1",
"formula_reduced": "HNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.806002439166666,
"spacegroup": 6
},
{
"id": "jvasp-118027",
"created_at": "2022-09-04T14:38:50.838058Z",
"updated_at": "2022-09-04T14:38:50.838093Z",
"structure_string": "H1 N1 Cl2\n1.0\n4.965236 0.000000 0.000000\n-0.000000 4.965236 -0.000000\n0.000000 -0.000000 3.832759\nH N Cl\n1 1 2\ndirect\n0.500000 0.500000 0.443508 H\n0.000000 0.000000 0.096426 N\n0.000000 0.000000 0.690683 Cl\n0.500000 0.500000 0.779384 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N",
"density": 1.5099247278946717,
"density_atomic": 0.042331990318176166,
"volume": 94.49118668730566,
"volume_molar": 14.22598067025982,
"formula_full": "H1 N1 Cl2",
"formula_reduced": "HNCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.16052534625,
"spacegroup": 99
},
{
"id": "jvasp-118023",
"created_at": "2022-09-04T14:38:50.588178Z",
"updated_at": "2022-09-04T14:38:50.588201Z",
"structure_string": "Mn1 H1 Cl1\n1.0\n4.140350 0.000000 0.000000\n-2.070175 3.585648 -0.000000\n-0.000000 -0.000000 3.279551\nMn H Cl\n1 1 1\ndirect\n0.666665 0.333333 0.000000 Mn\n0.333332 0.666666 0.000000 H\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mn",
"H",
"Cl"
],
"chemical_system": "Cl-H-Mn",
"density": 3.1172481298833326,
"density_atomic": 0.06161722811853403,
"volume": 48.687681864378135,
"volume_molar": 9.77346911551281,
"formula_full": "Mn1 H1 Cl1",
"formula_reduced": "MnHCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1752971029597696,
"spacegroup": 187
}
]
}