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=-updated_at&page=145",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=143",
"results": [
{
"id": "jvasp-118559",
"created_at": "2022-09-04T14:38:51.573622Z",
"updated_at": "2022-09-04T14:38:51.573633Z",
"structure_string": "Li1 S1 I1\n1.0\n5.061686 0.000000 -0.000000\n-2.530843 4.383549 0.000000\n-0.000000 -0.000000 3.974746\nLi S I\n1 1 1\ndirect\n0.333334 0.666667 0.000000 Li\n0.666667 0.333333 0.000000 S\n0.000000 0.000000 0.000000 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"S",
"I"
],
"chemical_system": "I-Li-S",
"density": 3.123866344899575,
"density_atomic": 0.03401659253496136,
"volume": 88.19225490962033,
"volume_molar": 17.70353910025116,
"formula_full": "Li1 S1 I1",
"formula_reduced": "LiSI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6384954250000001,
"spacegroup": 187
},
{
"id": "jvasp-113964",
"created_at": "2022-09-04T14:38:51.570139Z",
"updated_at": "2022-09-04T14:38:51.570164Z",
"structure_string": "Li1 B1 N1\n1.0\n5.554407 1.072828 0.000000\n1.391470 2.194519 0.000000\n0.000000 0.000000 3.484555\nLi B N\n1 1 1\ndirect\n-0.223249 0.067740 0.000000 Li\n0.327235 0.239818 0.000000 B\n0.206378 -0.079671 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"B",
"N"
],
"chemical_system": "B-Li-N",
"density": 1.4148978288576766,
"density_atomic": 0.0804886272675887,
"volume": 37.272346440029864,
"volume_molar": 7.481977223911491,
"formula_full": "Li1 B1 N1",
"formula_reduced": "LiBN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.911098611111111,
"spacegroup": 38
},
{
"id": "jvasp-118849",
"created_at": "2022-09-04T14:38:51.569345Z",
"updated_at": "2022-09-04T14:38:51.569366Z",
"structure_string": "Na1 Ca2 As1\n1.0\n-0.000000 3.737007 3.737007\n3.737007 -0.000000 3.737007\n3.737007 3.737007 0.000000\nNa Ca As\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ca",
"As"
],
"chemical_system": "As-Ca-Na",
"density": 2.8329030392934653,
"density_atomic": 0.03832289079562164,
"volume": 104.3762596441967,
"volume_molar": 15.7142131894915,
"formula_full": "Na1 Ca2 As1",
"formula_reduced": "NaCa2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0577828975,
"spacegroup": 225
},
{
"id": "jvasp-117479",
"created_at": "2022-09-04T14:38:51.564680Z",
"updated_at": "2022-09-04T14:38:51.564704Z",
"structure_string": "B1 H2\n1.0\n3.355249 -0.465831 0.507489\n0.921933 -1.767297 0.367870\n-0.562575 1.384911 -3.081324\nB H\n1 2\ndirect\n0.004702 0.889412 0.980135 B\n0.004437 0.283972 0.480164 H\n0.504644 0.494864 0.980033 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"H"
],
"chemical_system": "B-H",
"density": 1.3760737399956187,
"density_atomic": 0.19381743092452033,
"volume": 15.478483982012488,
"volume_molar": 3.1071203097028173,
"formula_full": "B1 H2",
"formula_reduced": "BH2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.0457741944444443,
"spacegroup": 115
},
{
"id": "jvasp-122585",
"created_at": "2022-09-04T14:38:51.561685Z",
"updated_at": "2022-09-04T14:38:51.561696Z",
"structure_string": "Mn1 Sn7\n1.0\n6.510344 -0.000000 -0.000000\n-0.000000 6.510344 -0.000000\n0.000000 0.000000 6.510344\nMn Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Mn\n0.238011 0.238011 0.738011 Sn\n0.000000 0.500000 0.000000 Sn\n0.238011 0.761988 0.261988 Sn\n0.500000 0.000000 0.000000 Sn\n0.761988 0.238011 0.261988 Sn\n0.500000 0.500000 0.500000 Sn\n0.761988 0.761988 0.738011 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 5.331211748569488,
"density_atomic": 0.028992000028487015,
"volume": 275.93818957434274,
"volume_molar": 20.77173273345321,
"formula_full": "Mn1 Sn7",
"formula_reduced": "MnSn7",
"formula_anonymous": "AB7",
"energy_above_hull": 1.0700098926724138,
"spacegroup": 215
},
{
"id": "jvasp-118603",
"created_at": "2022-09-04T14:38:51.559102Z",
"updated_at": "2022-09-04T14:38:51.559114Z",
"structure_string": "Li1 Nb1 Te1\n1.0\n2.942438 0.000000 0.000000\n0.000000 2.942438 -0.000000\n-0.000000 0.000000 8.274006\nLi Nb Te\n1 1 1\ndirect\n0.000000 0.000000 0.335589 Li\n0.000000 0.000000 0.666492 Nb\n0.000000 0.000000 0.007265 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Nb",
"Te"
],
"chemical_system": "Li-Nb-Te",
"density": 5.2722933120617705,
"density_atomic": 0.041878467622992466,
"volume": 71.63585895757357,
"volume_molar": 14.380040870200498,
"formula_full": "Li1 Nb1 Te1",
"formula_reduced": "LiNbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2680923888888898,
"spacegroup": 99
},
{
"id": "jvasp-118597",
"created_at": "2022-09-04T14:38:51.555354Z",
"updated_at": "2022-09-04T14:38:51.555375Z",
"structure_string": "Li2 Al1 O3\n1.0\n4.642582 -1.947387 -0.519719\n4.642582 1.947387 -0.519719\n-0.530462 0.000000 2.742020\nLi Al O\n2 1 3\ndirect\n0.813976 0.813976 0.813756 Li\n0.186025 0.186025 0.186244 Li\n0.500000 0.500000 0.500000 Al\n0.644576 0.644576 0.144262 O\n1.000000 1.000000 0.499999 O\n0.355424 0.355424 0.855738 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Al",
"O"
],
"chemical_system": "Al-Li-O",
"density": 3.042006750308888,
"density_atomic": 0.12369368282578991,
"volume": 48.506923417021994,
"volume_molar": 4.868592010864111,
"formula_full": "Li2 Al1 O3",
"formula_reduced": "Li2AlO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.49668555,
"spacegroup": 71
},
{
"id": "jvasp-118429",
"created_at": "2022-09-04T14:38:51.550455Z",
"updated_at": "2022-09-04T14:38:51.550471Z",
"structure_string": "H2 Pb2 I2\n1.0\n4.219577 -0.000000 0.000000\n0.000000 4.219577 -0.000000\n-0.000000 0.000000 8.612918\nH Pb I\n2 2 2\ndirect\n0.500001 0.500001 0.000000 H\n0.000000 0.000000 0.000000 H\n0.500001 0.000000 0.854654 Pb\n0.000000 0.500001 0.145346 Pb\n0.000000 0.500001 0.669363 I\n0.500001 0.000000 0.330637 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 7.257406659036524,
"density_atomic": 0.039125788688383255,
"volume": 153.35154130149064,
"volume_molar": 15.391742791342171,
"formula_full": "H2 Pb2 I2",
"formula_reduced": "HPbI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6875590316666671,
"spacegroup": 129
},
{
"id": "jvasp-111271",
"created_at": "2022-09-04T14:38:51.549656Z",
"updated_at": "2022-09-04T14:38:51.549678Z",
"structure_string": "Hf3 Pb1\n1.0\n4.014506 0.008631 -3.996770\n-0.687106 3.955277 -3.996770\n-0.007245 -0.008631 5.664837\nHf Pb\n3 1\ndirect\n0.750000 0.250000 0.500000 Hf\n0.249999 0.750001 0.500000 Hf\n0.500000 0.500000 0.000000 Hf\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hf",
"Pb"
],
"chemical_system": "Hf-Pb",
"density": 13.74747006565955,
"density_atomic": 0.04459003318184304,
"volume": 89.70614539997227,
"volume_molar": 13.505575865891487,
"formula_full": "Hf3 Pb1",
"formula_reduced": "Hf3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 4.159859955,
"spacegroup": 139
},
{
"id": "jvasp-117703",
"created_at": "2022-09-04T14:38:51.546685Z",
"updated_at": "2022-09-04T14:38:51.546700Z",
"structure_string": "Be2 S1\n1.0\n3.250299 -0.604954 -0.013767\n2.612582 -3.755089 -0.586258\n0.618913 0.159771 -4.263215\nBe S\n2 1\ndirect\n0.439741 0.346753 0.337151 Be\n0.467431 0.008477 0.760733 Be\n0.040053 0.886368 0.047938 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"S"
],
"chemical_system": "Be-S",
"density": 1.816791034568306,
"density_atomic": 0.06552870992007803,
"volume": 45.7814598159943,
"volume_molar": 9.190079840340047,
"formula_full": "Be2 S1",
"formula_reduced": "Be2S",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5742774000000002,
"spacegroup": 5
},
{
"id": "jvasp-120995",
"created_at": "2022-09-04T14:38:51.544716Z",
"updated_at": "2022-09-04T14:38:51.544736Z",
"structure_string": "Zr1 Cu1 F2\n1.0\n3.088725 0.000000 0.000000\n0.000000 3.088725 -0.000000\n0.000000 -0.000000 5.473946\nZr Cu F\n1 1 2\ndirect\n0.500001 0.500001 0.545739 Zr\n0.000000 0.000000 0.898844 Cu\n0.000000 0.000000 0.394785 F\n0.500001 0.500001 0.170632 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Cu",
"F"
],
"chemical_system": "Cu-F-Zr",
"density": 6.1294619656023315,
"density_atomic": 0.0765951014949837,
"volume": 52.222660743676464,
"volume_molar": 7.862305346503649,
"formula_full": "Zr1 Cu1 F2",
"formula_reduced": "ZrCuF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.42144387875,
"spacegroup": 99
},
{
"id": "jvasp-116888",
"created_at": "2022-09-04T14:38:51.544533Z",
"updated_at": "2022-09-04T14:38:51.544563Z",
"structure_string": "Li5 Mn5 Sn2 O12\n1.0\n5.321577 -0.040792 0.493416\n-2.729315 4.568554 0.493416\n0.074343 0.129851 10.131786\nLi Mn Sn O\n5 5 2 12\ndirect\n0.807861 0.675477 0.250323 Li\n0.667766 0.824434 0.744942 Li\n0.324522 0.192138 0.749678 Li\n0.175565 0.332232 0.255060 Li\n0.079185 0.920812 0.500001 Li\n0.915468 0.084533 0.000000 Mn\n0.005465 0.513834 0.740030 Mn\n0.486164 0.994533 0.259971 Mn\n0.580368 0.419631 0.000000 Mn\n0.422821 0.577178 0.500001 Mn\n0.247768 0.752230 0.000000 Sn\n0.753688 0.246312 0.500001 Sn\n0.202570 0.023689 0.126930 O\n0.060188 0.230022 0.616134 O\n0.769977 0.939811 0.383868 O\n0.877228 0.382273 0.123886 O\n0.617727 0.122772 0.876115 O\n0.691434 0.526689 0.615004 O\n0.473310 0.308565 0.384997 O\n0.524950 0.708705 0.122832 O\n0.291294 0.475048 0.877169 O\n0.395631 0.847274 0.610863 O\n0.152724 0.604367 0.389139 O\n0.976310 0.797429 0.873072 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Sn",
"O"
],
"chemical_system": "Li-Mn-O-Sn",
"density": 5.017458351835507,
"density_atomic": 0.09815542692612084,
"volume": 244.5101687353895,
"volume_molar": 6.135311055732779,
"formula_full": "Li5 Mn5 Sn2 O12",
"formula_reduced": "Li5Mn5(SnO6)2",
"formula_anonymous": "A2B5C5D12",
"energy_above_hull": 2.817820066954023,
"spacegroup": 5
}
]
}