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=85",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=83",
"results": [
{
"id": "jvasp-117929",
"created_at": "2022-09-04T14:38:53.266927Z",
"updated_at": "2022-09-04T14:38:53.266953Z",
"structure_string": "Tl1 C1 N2\n1.0\n1.953374 1.127781 5.084683\n-1.953374 1.127781 5.084683\n-0.000000 -2.255562 5.084683\nTl C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.499999 0.500002 C\n0.581168 0.581168 0.581171 N\n0.418831 0.418831 0.418833 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"C",
"N"
],
"chemical_system": "C-N-Tl",
"density": 6.038626092623357,
"density_atomic": 0.05951612977242716,
"volume": 67.2086712508839,
"volume_molar": 10.118501964134703,
"formula_full": "Tl1 C1 N2",
"formula_reduced": "TlCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.004619774999999,
"spacegroup": 166
},
{
"id": "jvasp-122930",
"created_at": "2022-09-04T14:38:53.266510Z",
"updated_at": "2022-09-04T14:38:53.266537Z",
"structure_string": "V1 Cd1\n1.0\n3.232696 -0.000000 -0.000000\n-0.000000 3.232696 -0.000000\n-0.000000 -0.000000 3.232696\nV Cd\n1 1\ndirect\n0.500001 0.500001 0.500001 V\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"Cd"
],
"chemical_system": "Cd-V",
"density": 8.029348079361665,
"density_atomic": 0.05920186634628997,
"volume": 33.782718745746685,
"volume_molar": 10.17221437711886,
"formula_full": "V1 Cd1",
"formula_reduced": "VCd",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-119595",
"created_at": "2022-09-04T14:38:53.265970Z",
"updated_at": "2022-09-04T14:38:53.265987Z",
"structure_string": "Bi4 C4 O12\n1.0\n5.099046 0.022111 0.007441\n-0.027258 6.382827 -2.024655\n-0.007450 -1.181940 8.736648\nBi C O\n4 4 12\ndirect\n0.749971 0.742146 0.164399 Bi\n0.249973 0.742169 0.664412 Bi\n0.750027 0.257831 0.335589 Bi\n0.250029 0.257854 0.835602 Bi\n0.749997 0.753034 0.834021 C\n0.249994 0.752989 0.334011 C\n0.750006 0.247012 0.665990 C\n0.250004 0.246967 0.165980 C\n0.250000 0.248451 0.313402 O\n0.749997 0.248513 0.813417 O\n0.529929 0.248282 0.592884 O\n0.970087 0.248270 0.592880 O\n0.029913 0.751731 0.407121 O\n0.970077 0.751752 0.907123 O\n0.250003 0.751488 0.186584 O\n0.750001 0.751549 0.686599 O\n0.029924 0.248248 0.092878 O\n0.529915 0.751764 0.907130 O\n0.470071 0.751718 0.407116 O\n0.470085 0.248236 0.092871 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Bi",
"C",
"O"
],
"chemical_system": "Bi-C-O",
"density": 6.565018247485239,
"density_atomic": 0.07348891571521103,
"volume": 272.14988553519123,
"volume_molar": 8.194624592554046,
"formula_full": "Bi4 C4 O12",
"formula_reduced": "BiCO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.75267296,
"spacegroup": 166
},
{
"id": "jvasp-120237",
"created_at": "2022-09-04T14:38:53.263957Z",
"updated_at": "2022-09-04T14:38:53.263982Z",
"structure_string": "H2 S1\n1.0\n3.634569 0.585416 1.191626\n-1.145678 -3.615915 -0.630955\n-0.973557 -1.552204 -3.910443\nH S\n2 1\ndirect\n0.184845 0.552221 0.768469 H\n0.567651 0.160140 0.151880 H\n0.142326 0.120591 0.961164 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 1.3011687805769392,
"density_atomic": 0.06897552133506916,
"volume": 43.49369083310882,
"volume_molar": 8.730837612296765,
"formula_full": "H2 S1",
"formula_reduced": "H2S",
"formula_anonymous": "AB2",
"energy_above_hull": 2.046996666666667,
"spacegroup": 44
},
{
"id": "jvasp-119217",
"created_at": "2022-09-04T14:38:53.263647Z",
"updated_at": "2022-09-04T14:38:53.263679Z",
"structure_string": "Al2 Co3 Ge1 O8\n1.0\n5.073135 0.079807 -2.916865\n-1.618679 4.724668 -3.050993\n-0.002611 -0.079807 5.851905\nAl Co Ge O\n2 3 1 8\ndirect\n0.617550 0.376071 0.241480 Al\n0.134592 0.376071 0.758521 Al\n0.245771 0.745771 0.500000 Co\n0.624780 0.394941 0.770161 Co\n0.624780 0.854619 0.229841 Co\n0.013723 0.013723 0.000000 Ge\n0.876760 0.138931 0.262173 O\n0.876760 0.614587 0.737829 O\n0.889165 0.142724 0.746441 O\n0.396284 0.142724 0.253561 O\n0.377671 0.598602 0.220932 O\n0.377671 0.156740 0.779068 O\n0.344976 0.597250 0.747726 O\n0.849525 0.597250 0.252276 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Al",
"Co",
"Ge",
"O"
],
"chemical_system": "Al-Co-Ge-O",
"density": 5.139857707603453,
"density_atomic": 0.10045048678768774,
"volume": 139.37214689253238,
"volume_molar": 5.995133475787333,
"formula_full": "Al2 Co3 Ge1 O8",
"formula_reduced": "Al2Co3GeO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.809123732142857,
"spacegroup": 44
},
{
"id": "jvasp-117497",
"created_at": "2022-09-04T14:38:53.262210Z",
"updated_at": "2022-09-04T14:38:53.262241Z",
"structure_string": "B2 I1\n1.0\n6.914507 0.214363 -1.231224\n1.422366 -3.876704 -0.058189\n-1.702104 -1.879266 -1.863623\nB I\n2 1\ndirect\n0.388821 0.271015 0.673449 B\n0.456441 0.203095 0.274983 B\n0.925373 0.918033 0.886247 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"I"
],
"chemical_system": "B-I",
"density": 4.029701390668191,
"density_atomic": 0.04901637197145647,
"volume": 61.20404018777603,
"volume_molar": 12.285978169716136,
"formula_full": "B2 I1",
"formula_reduced": "B2I",
"formula_anonymous": "AB2",
"energy_above_hull": 2.791983813888889,
"spacegroup": 42
},
{
"id": "jvasp-117928",
"created_at": "2022-09-04T14:38:53.260351Z",
"updated_at": "2022-09-04T14:38:53.260379Z",
"structure_string": "Tl1 C1 N2\n1.0\n1.952906 1.127511 5.093349\n-1.952906 1.127511 5.093349\n-0.000000 -2.255021 5.093349\nTl C N\n1 1 2\ndirect\n0.992077 0.992077 0.992077 Tl\n0.579556 0.579556 0.579556 C\n0.418696 0.418696 0.418696 N\n0.498672 0.498672 0.498672 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"C",
"N"
],
"chemical_system": "C-N-Tl",
"density": 6.031242128381525,
"density_atomic": 0.05944335411662215,
"volume": 67.29095387437903,
"volume_molar": 10.130889902654447,
"formula_full": "Tl1 C1 N2",
"formula_reduced": "TlCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.125904775,
"spacegroup": 160
},
{
"id": "jvasp-123369",
"created_at": "2022-09-04T14:38:53.259101Z",
"updated_at": "2022-09-04T14:38:53.259126Z",
"structure_string": "Zr1 Ag1\n1.0\n1.507638 -2.611303 -0.000000\n1.507638 2.611303 -0.000000\n0.000000 -0.000000 5.077273\nZr Ag\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 8.269675891456712,
"density_atomic": 0.05002823041298556,
"volume": 39.9774284137156,
"volume_molar": 12.037485056510942,
"formula_full": "Zr1 Ag1",
"formula_reduced": "ZrAg",
"formula_anonymous": "AB",
"energy_above_hull": 1.36538088,
"spacegroup": 187
},
{
"id": "jvasp-118544",
"created_at": "2022-09-04T14:38:53.252522Z",
"updated_at": "2022-09-04T14:38:53.252539Z",
"structure_string": "Hg1 Cl1\n1.0\n4.040703 0.000000 0.000000\n-0.000000 4.040703 0.000000\n-0.000000 0.000000 3.322457\nHg Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hg",
"Cl"
],
"chemical_system": "Cl-Hg",
"density": 7.225484838735082,
"density_atomic": 0.036868610188097665,
"volume": 54.246688166337826,
"volume_molar": 16.334059595075637,
"formula_full": "Hg1 Cl1",
"formula_reduced": "HgCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.270646,
"spacegroup": 123
},
{
"id": "jvasp-117961",
"created_at": "2022-09-04T14:38:53.251912Z",
"updated_at": "2022-09-04T14:38:53.251947Z",
"structure_string": "Ca1 C1\n1.0\n3.381135 -0.000000 -0.000000\n-0.000000 3.381135 -0.000000\n0.000000 0.000000 4.650167\nCa C\n1 1\ndirect\n0.000000 0.000000 0.749997 Ca\n0.000000 0.000000 0.250004 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ca",
"C"
],
"chemical_system": "C-Ca",
"density": 1.6270430479808973,
"density_atomic": 0.037621527359701715,
"volume": 53.16105273658558,
"volume_molar": 16.00716712647508,
"formula_full": "Ca1 C1",
"formula_reduced": "CaC",
"formula_anonymous": "AB",
"energy_above_hull": 3.03035021,
"spacegroup": 123
},
{
"id": "jvasp-123366",
"created_at": "2022-09-04T14:38:53.251334Z",
"updated_at": "2022-09-04T14:38:53.251357Z",
"structure_string": "Zn1 Ag3\n1.0\n4.073716 -0.000000 0.000000\n-0.000000 4.073716 0.000000\n0.000000 0.000000 4.073716\nZn Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"Ag"
],
"chemical_system": "Ag-Zn",
"density": 9.555240791646474,
"density_atomic": 0.059168116552094356,
"volume": 67.60397716020273,
"volume_molar": 10.178016659864149,
"formula_full": "Zn1 Ag3",
"formula_reduced": "ZnAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-117520",
"created_at": "2022-09-04T14:38:53.245083Z",
"updated_at": "2022-09-04T14:38:53.245112Z",
"structure_string": "B1 Te3\n1.0\n5.858064 0.584246 1.185040\n0.136242 -3.354093 0.534798\n-0.596945 -0.019688 -5.805501\nB Te\n1 3\ndirect\n0.985102 -0.083071 0.053294 B\n0.602118 0.851607 0.066689 Te\n0.284440 0.030112 0.399878 Te\n-0.046302 0.345673 0.787241 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"Te"
],
"chemical_system": "B-Te",
"density": 5.834170847745403,
"density_atomic": 0.03570448800989097,
"volume": 112.03073403242493,
"volume_molar": 16.866621244734635,
"formula_full": "B1 Te3",
"formula_reduced": "BTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.867523970833333,
"spacegroup": 1
}
]
}