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=chemical_system&page=939",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=937",
"results": [
{
"id": "jvasp-69367",
"created_at": "2022-09-04T14:35:42.961287Z",
"updated_at": "2022-09-04T14:35:42.961312Z",
"structure_string": "Ba1 Ru2 Pt1\n1.0\n4.268525 0.000000 0.000000\n0.000000 4.268525 0.000000\n0.000000 0.000000 4.307398\nBa Ru Pt\n1 2 1\ndirect\n0.499999 0.499999 0.500000 Ba\n0.499999 0.000000 0.000000 Ru\n0.000000 0.499999 -0.000000 Ru\n0.000000 -0.000000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ru",
"Pt"
],
"chemical_system": "Ba-Pt-Ru",
"density": 11.310129641618378,
"density_atomic": 0.05096703045300599,
"volume": 78.48210822657579,
"volume_molar": 11.815757572049835,
"formula_full": "Ba1 Ru2 Pt1",
"formula_reduced": "BaRu2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0473195925,
"spacegroup": 123
},
{
"id": "jvasp-69043",
"created_at": "2022-09-04T14:35:43.635104Z",
"updated_at": "2022-09-04T14:35:43.635138Z",
"structure_string": "Ba1 Ru2 Pt1\n1.0\n4.265410 0.000000 -0.000000\n0.000000 4.265410 -0.000000\n0.000000 0.000000 4.315681\nBa Ru Pt\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.500000 0.000000 Ru\n0.500000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ru",
"Pt"
],
"chemical_system": "Ba-Pt-Ru",
"density": 11.304916073610746,
"density_atomic": 0.05094353646241228,
"volume": 78.51830237485228,
"volume_molar": 11.821206728440067,
"formula_full": "Ba1 Ru2 Pt1",
"formula_reduced": "BaRu2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0470570925,
"spacegroup": 123
},
{
"id": "jvasp-96069",
"created_at": "2022-09-04T14:35:56.048133Z",
"updated_at": "2022-09-04T14:35:56.048157Z",
"structure_string": "Ba4 Pt8 S12\n1.0\n6.830992 0.000000 0.000000\n0.000000 6.830992 0.000000\n0.000000 0.000000 12.443571\nBa Pt S\n4 8 12\ndirect\n0.325283 0.325283 0.500000 Ba\n0.825283 0.174717 0.250000 Ba\n0.174717 0.825283 0.750000 Ba\n0.674717 0.674717 0.000000 Ba\n0.250215 0.992612 0.124744 Pt\n0.492612 0.249785 0.874744 Pt\n0.750215 0.507388 0.625256 Pt\n0.249785 0.492612 0.125256 Pt\n0.007388 0.749785 0.375256 Pt\n0.992612 0.250215 0.875256 Pt\n0.749785 0.007388 0.624744 Pt\n0.507388 0.750215 0.374744 Pt\n0.257132 0.840068 0.496467 S\n0.743517 0.256483 0.750000 S\n0.756483 0.756483 0.500000 S\n0.243517 0.243517 0.000000 S\n0.757132 0.659932 0.253533 S\n0.242868 0.340068 0.753533 S\n0.659932 0.757132 0.746467 S\n0.340068 0.242868 0.246467 S\n0.840068 0.257132 0.503533 S\n0.742868 0.159932 0.996467 S\n0.256483 0.743517 0.250000 S\n0.159932 0.742868 0.003533 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ba",
"Pt",
"S"
],
"chemical_system": "Ba-Pt-S",
"density": 7.134528645952261,
"density_atomic": 0.04133316465906898,
"volume": 580.6475308135914,
"volume_molar": 14.56975484377452,
"formula_full": "Ba4 Pt8 S12",
"formula_reduced": "BaPt2S3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.8008397949999997,
"spacegroup": 92
},
{
"id": "jvasp-16074",
"created_at": "2022-09-04T14:36:53.796460Z",
"updated_at": "2022-09-04T14:36:53.796480Z",
"structure_string": "Ba1 Sb1 Pt1\n1.0\n2.309796 -4.000684 0.000000\n2.309796 4.000684 -0.000000\n-0.000000 0.000000 4.881664\nBa Sb Pt\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666668 0.333334 0.500000 Sb\n0.333334 0.666668 0.500000 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Pt"
],
"chemical_system": "Ba-Pt-Sb",
"density": 8.35916202910281,
"density_atomic": 0.033251826113270634,
"volume": 90.22060893078938,
"volume_molar": 18.11070688113756,
"formula_full": "Ba1 Sb1 Pt1",
"formula_reduced": "BaSbPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8521878233333332,
"spacegroup": 187
},
{
"id": "jvasp-66589",
"created_at": "2022-09-04T14:36:10.936886Z",
"updated_at": "2022-09-04T14:36:10.936907Z",
"structure_string": "Ba4 Sb1 Pt1\n1.0\n0.000000 4.820849 4.820849\n4.820849 0.000000 4.820849\n4.820849 4.820849 -0.000000\nBa Sb Pt\n4 1 1\ndirect\n0.125484 0.624838 0.624838 Ba\n0.624838 0.624838 0.624838 Ba\n0.624838 0.125484 0.624838 Ba\n0.624838 0.624838 0.125484 Ba\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Pt"
],
"chemical_system": "Ba-Pt-Sb",
"density": 6.418634240256946,
"density_atomic": 0.026776306395510912,
"volume": 224.07870269238884,
"volume_molar": 22.49055814886261,
"formula_full": "Ba4 Sb1 Pt1",
"formula_reduced": "Ba4SbPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6303218966666666,
"spacegroup": 216
},
{
"id": "jvasp-69044",
"created_at": "2022-09-04T14:35:47.341499Z",
"updated_at": "2022-09-04T14:35:47.341528Z",
"structure_string": "Ba1 Sc4 Pt1\n1.0\n0.000000 4.200121 4.200121\n4.200121 0.000000 4.200121\n4.200121 4.200121 0.000000\nBa Sc Pt\n1 4 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.118896 0.627034 0.627034 Sc\n0.627034 0.627034 0.627034 Sc\n0.627034 0.118896 0.627034 Sc\n0.627034 0.627034 0.118896 Sc\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Pt"
],
"chemical_system": "Ba-Pt-Sc",
"density": 5.739877804797286,
"density_atomic": 0.04048888793360318,
"volume": 148.18880700895676,
"volume_molar": 14.873564247740202,
"formula_full": "Ba1 Sc4 Pt1",
"formula_reduced": "BaSc4Pt",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4155580616666663,
"spacegroup": 216
},
{
"id": "jvasp-64117",
"created_at": "2022-09-04T14:36:06.739546Z",
"updated_at": "2022-09-04T14:36:06.739563Z",
"structure_string": "Ba4 Sc1 Pt1\n1.0\n0.000000 4.891665 4.891665\n4.891665 0.000000 4.891665\n4.891665 4.891665 -0.000000\nBa Sc Pt\n4 1 1\ndirect\n0.128795 0.623734 0.623734 Ba\n0.623734 0.623734 0.623734 Ba\n0.623734 0.128795 0.623734 Ba\n0.623734 0.623734 0.128795 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Pt"
],
"chemical_system": "Ba-Pt-Sc",
"density": 5.599089950950307,
"density_atomic": 0.025630149123021924,
"volume": 234.09930122531296,
"volume_molar": 23.49631572994125,
"formula_full": "Ba4 Sc1 Pt1",
"formula_reduced": "Ba4ScPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8988517549999999,
"spacegroup": 216
},
{
"id": "jvasp-66445",
"created_at": "2022-09-04T14:35:40.742803Z",
"updated_at": "2022-09-04T14:35:40.742822Z",
"structure_string": "Ba4 Pt1 Se1\n1.0\n0.000000 4.778587 4.778587\n4.778587 0.000000 4.778587\n4.778587 4.778587 -0.000000\nBa Pt Se\n4 1 1\ndirect\n0.124746 0.625085 0.625085 Ba\n0.625085 0.625085 0.625085 Ba\n0.625085 0.124746 0.625085 Ba\n0.625085 0.625085 0.124746 Ba\n0.250000 0.250000 0.250000 Pt\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Pt",
"Se"
],
"chemical_system": "Ba-Pt-Se",
"density": 6.264784763958484,
"density_atomic": 0.027493039933855126,
"volume": 218.2370525207566,
"volume_molar": 21.904237488791818,
"formula_full": "Ba4 Pt1 Se1",
"formula_reduced": "Ba4PtSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5814664411111111,
"spacegroup": 216
},
{
"id": "jvasp-92682",
"created_at": "2022-09-04T14:36:32.839574Z",
"updated_at": "2022-09-04T14:36:32.839601Z",
"structure_string": "Ba1 Si3 Pt1\n1.0\n4.479724 0.000000 -0.000000\n0.000000 4.479724 0.000000\n-2.239862 -2.239862 5.063674\nBa Si Pt\n1 3 1\ndirect\n0.601701 0.601701 0.203404 Ba\n0.994504 0.994504 0.989009 Si\n0.856371 0.356372 0.712742 Si\n0.356372 0.856371 0.712742 Si\n0.249849 0.249849 0.499699 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Pt"
],
"chemical_system": "Ba-Pt-Si",
"density": 6.808798334967402,
"density_atomic": 0.04920415198425275,
"volume": 101.6174407720754,
"volume_molar": 12.239090640008023,
"formula_full": "Ba1 Si3 Pt1",
"formula_reduced": "BaSi3Pt",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.390428634,
"spacegroup": 107
},
{
"id": "jvasp-66687",
"created_at": "2022-09-04T14:36:12.895793Z",
"updated_at": "2022-09-04T14:36:12.895817Z",
"structure_string": "Ba4 Si1 Pt1\n1.0\n0.000000 4.754056 4.754056\n4.754056 0.000000 4.754056\n4.754056 4.754056 0.000000\nBa Si Pt\n4 1 1\ndirect\n0.125620 0.624794 0.624794 Ba\n0.624794 0.624794 0.624794 Ba\n0.624794 0.125620 0.624794 Ba\n0.624794 0.624794 0.125620 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Pt"
],
"chemical_system": "Ba-Pt-Si",
"density": 5.9691440676570755,
"density_atomic": 0.027920833270539843,
"volume": 214.89329999082764,
"volume_molar": 21.568628348761184,
"formula_full": "Ba4 Si1 Pt1",
"formula_reduced": "Ba4SiPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9736756466666664,
"spacegroup": 216
},
{
"id": "jvasp-66667",
"created_at": "2022-09-04T14:36:22.079050Z",
"updated_at": "2022-09-04T14:36:22.079075Z",
"structure_string": "Ba4 Sn1 Pt1\n1.0\n0.000000 4.821624 4.821624\n4.821624 0.000000 4.821624\n4.821624 4.821624 -0.000000\nBa Sn Pt\n4 1 1\ndirect\n0.126263 0.624578 0.624578 Ba\n0.624578 0.624578 0.624578 Ba\n0.624578 0.126263 0.624578 Ba\n0.624578 0.624578 0.126263 Ba\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Pt"
],
"chemical_system": "Ba-Pt-Sn",
"density": 6.39294847486209,
"density_atomic": 0.026763396864114324,
"volume": 224.1867887870801,
"volume_molar": 22.501406643469767,
"formula_full": "Ba4 Sn1 Pt1",
"formula_reduced": "Ba4SnPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4289928299999999,
"spacegroup": 216
},
{
"id": "jvasp-18628",
"created_at": "2022-09-04T14:36:34.880414Z",
"updated_at": "2022-09-04T14:36:34.880430Z",
"structure_string": "Ba1 Sn3 Pt1\n1.0\n4.620338 0.000000 -1.854124\n-0.744053 4.560034 -1.854124\n-0.023495 -0.027639 6.625282\nBa Sn Pt\n1 3 1\ndirect\n0.002254 0.002254 0.004510 Ba\n0.753080 0.253079 0.506159 Sn\n0.253080 0.753079 0.506159 Sn\n0.416746 0.416746 0.833493 Sn\n0.653940 0.653939 0.307881 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Pt"
],
"chemical_system": "Ba-Pt-Sn",
"density": 8.218802783424199,
"density_atomic": 0.03594178651493859,
"volume": 139.11384170961662,
"volume_molar": 16.755262728793408,
"formula_full": "Ba1 Sn3 Pt1",
"formula_reduced": "BaSn3Pt",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.6336764940000001,
"spacegroup": 107
}
]
}