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=volume_molar&page=4190",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=4188",
"results": [
{
"id": "jvasp-99485",
"created_at": "2022-09-04T14:36:19.859583Z",
"updated_at": "2022-09-04T14:36:19.859601Z",
"structure_string": "K2 Se6\n1.0\n6.345291 0.577345 0.739459\n3.627528 5.238042 0.739459\n-0.328541 -0.191580 8.057735\nK Se\n2 6\ndirect\n0.985505 0.846378 0.728622 K\n0.153621 0.014496 0.271377 K\n0.976893 0.610249 0.373469 Se\n0.389750 0.023107 0.626530 Se\n0.720363 0.871649 0.132371 Se\n0.128350 0.279637 0.867629 Se\n0.652552 0.469030 0.869089 Se\n0.530970 0.347448 0.130911 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Se"
],
"chemical_system": "K-Se",
"density": 3.6305181588108772,
"density_atomic": 0.03168871087567492,
"volume": 252.45583612998934,
"volume_molar": 19.00405726072862,
"formula_full": "K2 Se6",
"formula_reduced": "KSe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.8950133541666667,
"spacegroup": 5
},
{
"id": "jvasp-123729",
"created_at": "2022-09-04T14:38:55.171959Z",
"updated_at": "2022-09-04T14:38:55.171985Z",
"structure_string": "Ba1 Hf1\n1.0\n1.727975 -2.992941 0.000000\n1.727975 2.992941 0.000000\n0.000000 0.000000 6.101856\nBa Hf\n1 1\ndirect\n0.666668 0.333335 0.250000 Ba\n0.333335 0.666668 0.750000 Hf\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Hf"
],
"chemical_system": "Ba-Hf",
"density": 8.309158448679401,
"density_atomic": 0.031688554949469455,
"volume": 63.11426959005225,
"volume_molar": 19.00415077179411,
"formula_full": "Ba1 Hf1",
"formula_reduced": "BaHf",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 187
},
{
"id": "jvasp-22422",
"created_at": "2022-09-04T14:38:29.713551Z",
"updated_at": "2022-09-04T14:38:29.713577Z",
"structure_string": "Th7 Te12\n1.0\n6.295001 -10.903260 -0.000000\n6.295000 10.903260 0.000000\n0.000000 -0.000000 4.367984\nTh Te\n7 12\ndirect\n0.560700 0.723065 0.000000 Th\n0.276935 0.837635 0.000000 Th\n0.162365 0.439300 0.000000 Th\n0.835265 0.547412 0.500000 Th\n0.452588 0.287852 0.500000 Th\n0.712148 0.164735 0.500000 Th\n0.000000 0.000000 0.000000 Th\n0.782090 0.786284 0.500000 Te\n0.213716 0.995807 0.500000 Te\n0.004193 0.217909 0.500000 Te\n0.478179 0.864609 0.500000 Te\n0.868083 0.375826 0.000000 Te\n0.752844 0.008513 0.000000 Te\n0.624174 0.492257 0.000000 Te\n0.386429 0.521821 0.500000 Te\n0.255668 0.247156 0.000000 Te\n0.991487 0.744332 0.000000 Te\n0.507743 0.131917 0.000000 Te\n0.135391 0.613571 0.500000 Te\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Th",
"Te"
],
"chemical_system": "Te-Th",
"density": 8.738753486330037,
"density_atomic": 0.0316876789332566,
"volume": 599.6021368437708,
"volume_molar": 19.004676147736685,
"formula_full": "Th7 Te12",
"formula_reduced": "Th7Te12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.2281206526315795,
"spacegroup": 174
},
{
"id": "jvasp-120254",
"created_at": "2022-09-04T14:38:46.457037Z",
"updated_at": "2022-09-04T14:38:46.457074Z",
"structure_string": "Ge1 I1\n1.0\n4.265914 -0.324985 -0.444798\n-0.344443 -4.380411 -0.110622\n-0.563205 -2.754954 -3.392517\nGe I\n1 1\ndirect\n0.462162 0.301780 0.321805 Ge\n0.962360 0.064665 0.085994 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"I"
],
"chemical_system": "Ge-I",
"density": 5.248813047365524,
"density_atomic": 0.031681249803698554,
"volume": 63.12882264406483,
"volume_molar": 19.008532798781687,
"formula_full": "Ge1 I1",
"formula_reduced": "GeI",
"formula_anonymous": "AB",
"energy_above_hull": 0.3195614874999999,
"spacegroup": 38
},
{
"id": "jvasp-38497",
"created_at": "2022-09-04T14:37:41.961042Z",
"updated_at": "2022-09-04T14:37:41.961066Z",
"structure_string": "Pr1 Dy3\n1.0\n5.016896 -0.000000 -0.000000\n0.000000 5.016896 0.000000\n0.000000 0.000000 5.016896\nPr Dy\n1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.500000 0.500000 Dy\n0.500000 0.000000 0.500000 Dy\n0.500000 0.500000 0.000000 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Dy"
],
"chemical_system": "Dy-Pr",
"density": 8.263904051630197,
"density_atomic": 0.03167777696102176,
"volume": 126.2714869456225,
"volume_molar": 19.01061670902603,
"formula_full": "Pr1 Dy3",
"formula_reduced": "PrDy3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4818798375,
"spacegroup": 221
},
{
"id": "jvasp-108160",
"created_at": "2022-09-04T14:38:06.651532Z",
"updated_at": "2022-09-04T14:38:06.651553Z",
"structure_string": "Ba2 Al1 In3\n1.0\n4.995004 -0.000968 4.224625\n2.271702 4.448532 4.224625\n0.002943 0.001801 8.527641\nBa Al In\n2 1 3\ndirect\n0.747072 0.747073 0.803463 Ba\n0.250335 0.250335 0.197055 Ba\n0.571136 0.571136 0.591055 Al\n0.439861 0.439861 0.408821 In\n0.066960 0.066960 0.763346 In\n0.924631 0.924631 0.236268 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Al",
"In"
],
"chemical_system": "Al-Ba-In",
"density": 5.663588104139007,
"density_atomic": 0.031673868165838705,
"volume": 189.43060470495976,
"volume_molar": 19.01296276308643,
"formula_full": "Ba2 Al1 In3",
"formula_reduced": "Ba2AlIn3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-102742",
"created_at": "2022-09-04T14:37:01.951276Z",
"updated_at": "2022-09-04T14:37:01.951305Z",
"structure_string": "Hg2 Te1 S1\n1.0\n4.283053 0.007239 6.479462\n1.953348 3.811696 6.479462\n0.011822 0.007239 7.767099\nHg Te S\n2 1 1\ndirect\n0.991160 0.991163 0.991161 Hg\n0.507533 0.507535 0.507534 Hg\n0.377205 0.377206 0.377206 Te\n0.874098 0.874100 0.874099 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Te",
"S"
],
"chemical_system": "Hg-S-Te",
"density": 7.374175278867237,
"density_atomic": 0.031672438219898416,
"volume": 126.29277140674866,
"volume_molar": 19.01382115954859,
"formula_full": "Hg2 Te1 S1",
"formula_reduced": "Hg2TeS",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-7781",
"created_at": "2022-09-04T14:37:03.816852Z",
"updated_at": "2022-09-04T14:37:03.816871Z",
"structure_string": "Sc1 Tl1 Te2\n1.0\n4.108155 -0.001509 7.384829\n1.914665 3.634693 7.384829\n-0.002502 -0.001509 8.450599\nSc Tl Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500002 0.499999 0.499999 Tl\n0.734492 0.734488 0.734488 Te\n0.265511 0.265510 0.265510 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Tl",
"Te"
],
"chemical_system": "Sc-Te-Tl",
"density": 6.633500342020041,
"density_atomic": 0.031670777497435,
"volume": 126.29939382839459,
"volume_molar": 19.014818188431686,
"formula_full": "Sc1 Tl1 Te2",
"formula_reduced": "ScTlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7038458458333335,
"spacegroup": 166
},
{
"id": "jvasp-12807",
"created_at": "2022-09-04T14:38:13.997305Z",
"updated_at": "2022-09-04T14:38:13.997316Z",
"structure_string": "Rb8 In4 S10\n1.0\n7.074328 -0.044914 2.594368\n-0.256271 8.948517 2.749740\n-0.079995 -0.037857 10.933792\nRb In S\n8 4 10\ndirect\n0.766610 0.473666 0.664058 Rb\n0.233391 0.526335 0.335942 Rb\n0.506320 0.790639 0.912057 Rb\n0.459110 0.816256 0.452509 Rb\n0.540891 0.183745 0.547491 Rb\n0.880101 0.818848 0.090111 Rb\n0.119900 0.181153 0.909889 Rb\n0.493682 0.209362 0.087943 Rb\n0.031216 -0.007070 0.341114 In\n0.123286 0.593134 0.827517 In\n0.876715 0.406866 0.172482 In\n0.968785 0.007071 0.658886 In\n0.729906 0.521068 0.351975 S\n0.735873 0.113519 0.819468 S\n0.270095 0.478933 0.648025 S\n0.219006 0.479573 0.038460 S\n0.178648 0.158553 0.429102 S\n0.821354 0.841448 0.570898 S\n0.199490 0.870668 0.768017 S\n0.800511 0.129332 0.231983 S\n0.780995 0.520428 0.961540 S\n0.264128 0.886482 0.180531 S\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Rb",
"In",
"S"
],
"chemical_system": "In-Rb-S",
"density": 3.498775068001714,
"density_atomic": 0.03167000242651649,
"volume": 694.6636663841856,
"volume_molar": 19.015283544651115,
"formula_full": "Rb8 In4 S10",
"formula_reduced": "Rb4In2S5",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 0.4199399945454546,
"spacegroup": 2
},
{
"id": "jvasp-8506",
"created_at": "2022-09-04T14:37:05.764964Z",
"updated_at": "2022-09-04T14:37:05.764981Z",
"structure_string": "Pb2 Se2\n1.0\n4.323732 0.050792 -0.731636\n-0.174464 4.320509 -0.731636\n-1.007904 -1.061838 7.113685\nPb Se\n2 2\ndirect\n0.850389 0.850387 0.717514 Pb\n0.132873 0.132873 0.282485 Pb\n0.347533 0.347532 0.712325 Se\n0.635208 0.635208 0.287675 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 7.524103826443662,
"density_atomic": 0.03166844587039204,
"volume": 126.30869277168232,
"volume_molar": 19.016218177066637,
"formula_full": "Pb2 Se2",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2954970933333333,
"spacegroup": 139
},
{
"id": "jvasp-107679",
"created_at": "2022-09-04T14:37:01.732657Z",
"updated_at": "2022-09-04T14:37:01.732678Z",
"structure_string": "Na1 Y3\n1.0\n4.450434 -0.093934 -4.482880\n-0.821688 4.374930 -4.482880\n0.079622 0.093934 6.316347\nNa Y\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.749999 0.250000 0.500000 Y\n0.249999 0.750000 0.499999 Y\n0.499999 0.500000 -0.000000 Y\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Y"
],
"chemical_system": "Na-Y",
"density": 3.808676778695905,
"density_atomic": 0.03166835789386264,
"volume": 126.30904366453444,
"volume_molar": 19.016271005220315,
"formula_full": "Na1 Y3",
"formula_reduced": "NaY3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0721488375,
"spacegroup": 139
},
{
"id": "jvasp-101468",
"created_at": "2022-09-04T14:38:40.877398Z",
"updated_at": "2022-09-04T14:38:40.877425Z",
"structure_string": "Bi2 Sb2 Te3 Se3\n1.0\n4.202424 -0.023185 19.751461\n2.058244 3.663951 19.751461\n-0.039868 -0.023185 20.193538\nBi Sb Te Se\n2 2 3 3\ndirect\n0.199874 0.199875 0.199875 Bi\n0.695621 0.695625 0.695624 Bi\n0.300649 0.300650 0.300650 Sb\n0.804812 0.804817 0.804816 Sb\n0.392751 0.392753 0.392752 Te\n0.605191 0.605194 0.605193 Te\n0.109154 0.109155 0.109154 Te\n0.997796 0.997802 0.997801 Se\n0.501840 0.501843 0.501843 Se\n0.892292 0.892297 0.892296 Se\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Bi",
"Sb",
"Te",
"Se"
],
"chemical_system": "Bi-Sb-Se-Te",
"density": 6.73705653292777,
"density_atomic": 0.031667767826949786,
"volume": 315.7784929662721,
"volume_molar": 19.016625336235606,
"formula_full": "Bi2 Sb2 Te3 Se3",
"formula_reduced": "Bi2Sb2(TeSe)3",
"formula_anonymous": "A2B2C3D3",
"energy_above_hull": 1.40191742,
"spacegroup": 160
}
]
}