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=404",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=402",
"results": [
{
"id": "jvasp-9083",
"created_at": "2022-09-04T14:37:16.521113Z",
"updated_at": "2022-09-04T14:37:16.521140Z",
"structure_string": "Sb8 Ir4\n1.0\n0.000000 6.709150 -0.007532\n6.651956 0.000000 0.000000\n0.000000 -2.863545 -6.173406\nSb Ir\n8 4\ndirect\n0.149165 0.134859 0.877330 Sb\n0.850834 0.634859 0.622671 Sb\n0.850835 0.865142 0.122670 Sb\n0.149165 0.365141 0.377329 Sb\n0.344376 0.637367 0.176999 Sb\n0.655624 0.137367 0.323001 Sb\n0.655624 0.362634 0.823002 Sb\n0.344376 0.862634 0.676999 Sb\n0.270948 0.499066 0.789307 Ir\n0.729051 0.999066 0.710694 Ir\n0.729051 0.500935 0.210694 Ir\n0.270948 0.000935 0.289306 Ir\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sb",
"Ir"
],
"chemical_system": "Ir-Sb",
"density": 10.499429996654177,
"density_atomic": 0.043532483145660154,
"volume": 275.65622571650397,
"volume_molar": 13.833671605292658,
"formula_full": "Sb8 Ir4",
"formula_reduced": "Sb2Ir",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2067677666666663,
"spacegroup": 14
},
{
"id": "jvasp-90829",
"created_at": "2022-09-04T14:36:16.055689Z",
"updated_at": "2022-09-04T14:36:16.055723Z",
"structure_string": "Tb2 Sn6\n1.0\n4.431591 0.000000 0.000000\n0.000000 4.457196 0.000000\n0.000000 -2.228598 11.087169\nTb Sn\n2 6\ndirect\n0.500000 0.482332 0.964665 Tb\n0.000000 0.209637 0.419272 Tb\n0.500000 0.098213 0.196428 Sn\n0.500000 0.734592 0.469183 Sn\n0.500000 0.868597 0.737195 Sn\n0.000000 0.975472 0.950944 Sn\n0.000000 0.358985 0.717970 Sn\n0.000000 0.598172 0.196344 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tb",
"Sn"
],
"chemical_system": "Sn-Tb",
"density": 7.810717393804865,
"density_atomic": 0.03652985225632803,
"volume": 218.99896949663045,
"volume_molar": 16.485532757545688,
"formula_full": "Tb2 Sn6",
"formula_reduced": "TbSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.571758375,
"spacegroup": 38
},
{
"id": "jvasp-90828",
"created_at": "2022-09-04T14:36:09.244878Z",
"updated_at": "2022-09-04T14:36:09.244886Z",
"structure_string": "Er2 Co2 Ge4\n1.0\n0.000000 0.000000 -4.151308\n-4.085976 -0.000000 0.000000\n2.042988 8.279295 -0.000000\nEr Co Ge\n2 2 4\ndirect\n0.750000 0.109887 0.219774 Er\n0.250000 0.890114 0.780226 Er\n0.750000 0.320227 0.640454 Co\n0.250000 0.679774 0.359547 Co\n0.750000 0.455982 0.911964 Ge\n0.250000 0.544019 0.088037 Ge\n0.750000 0.748754 0.497506 Ge\n0.250000 0.251247 0.502495 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Er",
"Co",
"Ge"
],
"chemical_system": "Co-Er-Ge",
"density": 8.784787895845136,
"density_atomic": 0.056966017899461756,
"volume": 140.43460110059033,
"volume_molar": 10.571461692527574,
"formula_full": "Er2 Co2 Ge4",
"formula_reduced": "ErCoGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4085057,
"spacegroup": 63
},
{
"id": "jvasp-90827",
"created_at": "2022-09-04T14:36:04.716061Z",
"updated_at": "2022-09-04T14:36:04.716098Z",
"structure_string": "Li2 Tm2 Sn4\n1.0\n-4.366871 0.000000 -0.000000\n0.000000 -0.000000 -4.435137\n2.183435 -9.483918 0.000000\nLi Tm Sn\n2 2 4\ndirect\n0.674380 0.750001 0.348759 Li\n0.325621 0.250000 0.651241 Li\n0.890957 0.750001 0.781913 Tm\n0.109044 0.250000 0.218088 Tm\n0.546286 0.750001 0.092574 Sn\n0.453715 0.250000 0.907426 Sn\n0.251235 0.750001 0.502467 Sn\n0.748766 0.250000 0.497533 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Tm",
"Sn"
],
"chemical_system": "Li-Sn-Tm",
"density": 7.4726436487509025,
"density_atomic": 0.04355367381843059,
"volume": 183.68140500273122,
"volume_molar": 13.826940949012695,
"formula_full": "Li2 Tm2 Sn4",
"formula_reduced": "LiTmSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6230269125000001,
"spacegroup": 63
},
{
"id": "jvasp-90826",
"created_at": "2022-09-04T14:36:00.045975Z",
"updated_at": "2022-09-04T14:36:00.045992Z",
"structure_string": "Ce2 Cu2 Si4\n1.0\n-4.206169 -0.000000 0.000000\n-0.000000 0.000000 -4.103632\n2.103084 -8.344171 0.000000\nCe Cu Si\n2 2 4\ndirect\n0.896742 0.750000 0.793482 Ce\n0.103259 0.250000 0.206518 Ce\n0.676534 0.750000 0.353069 Cu\n0.323467 0.250000 0.646931 Cu\n0.536475 0.750000 0.072950 Si\n0.463526 0.250000 0.927050 Si\n0.248250 0.750000 0.496499 Si\n0.751751 0.250000 0.503501 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Cu",
"Si"
],
"chemical_system": "Ce-Cu-Si",
"density": 5.991493315207006,
"density_atomic": 0.05554585617568926,
"volume": 144.02514518268165,
"volume_molar": 10.84174621586931,
"formula_full": "Ce2 Cu2 Si4",
"formula_reduced": "CeCuSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8708957875,
"spacegroup": 63
},
{
"id": "jvasp-90825",
"created_at": "2022-09-04T14:35:56.274881Z",
"updated_at": "2022-09-04T14:35:56.274896Z",
"structure_string": "Na4 N4\n1.0\n-4.571299 -3.778617 0.000000\n-4.571299 3.778617 0.000000\n4.571299 0.000000 -4.682716\nNa N\n4 4\ndirect\n0.517157 0.017157 0.034315 Na\n0.982844 0.482843 0.965686 Na\n0.732844 0.732844 0.465686 Na\n0.267157 0.267157 0.534315 Na\n0.184776 0.684776 0.500000 N\n0.315224 0.815225 0.500000 N\n0.065224 0.065224 0.000000 N\n0.934776 0.934776 0.000000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"N"
],
"chemical_system": "N-Na",
"density": 1.5190394428708194,
"density_atomic": 0.049452661435812346,
"volume": 161.7708687000333,
"volume_molar": 12.177586777238485,
"formula_full": "Na4 N4",
"formula_reduced": "NaN",
"formula_anonymous": "AB",
"energy_above_hull": 1.4909511249999996,
"spacegroup": 70
},
{
"id": "jvasp-90824",
"created_at": "2022-09-04T14:35:50.376227Z",
"updated_at": "2022-09-04T14:35:50.376245Z",
"structure_string": "Zr4 Cu4\n1.0\n-3.137660 -4.125430 0.881955\n-3.137660 4.125430 0.881955\n0.036575 0.000000 -5.444781\nZr Cu\n4 4\ndirect\n0.097302 0.097302 0.002333 Zr\n0.594710 0.594710 0.021730 Zr\n0.725773 0.172179 0.404667 Zr\n0.172179 0.725773 0.404667 Zr\n0.277943 0.277943 0.552555 Cu\n0.696368 0.696368 0.562321 Cu\n0.055969 0.556277 0.848093 Cu\n0.556277 0.055969 0.848093 Cu\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Cu"
],
"chemical_system": "Cu-Zr",
"density": 7.30686627307539,
"density_atomic": 0.05686241161228027,
"volume": 140.6904802868453,
"volume_molar": 10.590723448492344,
"formula_full": "Zr4 Cu4",
"formula_reduced": "ZrCu",
"formula_anonymous": "AB",
"energy_above_hull": 1.214267475,
"spacegroup": 8
},
{
"id": "jvasp-90822",
"created_at": "2022-09-04T14:35:46.808590Z",
"updated_at": "2022-09-04T14:35:46.808616Z",
"structure_string": "Tl6 Ir2\n1.0\n5.718129 0.000000 -0.000000\n0.000000 5.718129 -0.000000\n-0.000000 0.000000 5.718129\nTl Ir\n6 2\ndirect\n0.000000 0.500000 0.750000 Tl\n0.500000 0.250000 0.000000 Tl\n0.750000 0.000000 0.500000 Tl\n0.000000 0.500000 0.250000 Tl\n0.500000 0.750000 0.000000 Tl\n0.250000 0.000000 0.500000 Tl\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tl",
"Ir"
],
"chemical_system": "Ir-Tl",
"density": 14.305762915477693,
"density_atomic": 0.04278860627918367,
"volume": 186.96565968524988,
"volume_molar": 14.0741689988854,
"formula_full": "Tl6 Ir2",
"formula_reduced": "Tl3Ir",
"formula_anonymous": "AB3",
"energy_above_hull": 0.805612225,
"spacegroup": 223
},
{
"id": "jvasp-90821",
"created_at": "2022-09-04T14:35:44.130032Z",
"updated_at": "2022-09-04T14:35:44.130057Z",
"structure_string": "Th2 Ag2 P2 O2\n1.0\n3.993617 -0.000000 -0.000000\n-0.000000 3.993617 0.000000\n-0.000000 0.000000 8.802638\nTh Ag P O\n2 2 2 2\ndirect\n0.750001 0.750001 0.845157 Th\n0.250000 0.250000 0.154843 Th\n0.750001 0.250000 0.500000 Ag\n0.250000 0.750001 0.500000 Ag\n0.750001 0.750001 0.297159 P\n0.250000 0.250000 0.702841 P\n0.750001 0.250000 0.000000 O\n0.250000 0.750001 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Th",
"Ag",
"P",
"O"
],
"chemical_system": "Ag-O-P-Th",
"density": 9.15185343660023,
"density_atomic": 0.056982870108963773,
"volume": 140.39306873631043,
"volume_molar": 10.56833527073021,
"formula_full": "Th2 Ag2 P2 O2",
"formula_reduced": "ThAgPO",
"formula_anonymous": "ABCD",
"energy_above_hull": 1.6165254649999998,
"spacegroup": 129
},
{
"id": "jvasp-90820",
"created_at": "2022-09-04T14:36:22.150100Z",
"updated_at": "2022-09-04T14:36:22.150129Z",
"structure_string": "Zr4 Pb2 C2\n1.0\n-1.707028 -2.956664 0.000000\n-1.707028 2.956664 -0.000000\n0.000000 -0.000000 -14.891137\nZr Pb C\n4 2 2\ndirect\n0.666676 0.333326 0.582475 Zr\n0.333326 0.666676 0.417526 Zr\n0.333326 0.666676 0.082474 Zr\n0.666676 0.333326 0.917526 Zr\n0.666674 0.333327 0.250000 Pb\n0.333327 0.666674 0.750000 Pb\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Pb",
"C"
],
"chemical_system": "C-Pb-Zr",
"density": 8.874334577688249,
"density_atomic": 0.05322179452021566,
"volume": 150.31436035027522,
"volume_molar": 11.315177953484005,
"formula_full": "Zr4 Pb2 C2",
"formula_reduced": "Zr2PbC",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.538397455,
"spacegroup": 194
},
{
"id": "jvasp-9082",
"created_at": "2022-09-04T14:37:14.127595Z",
"updated_at": "2022-09-04T14:37:14.127618Z",
"structure_string": "Ga4 O6\n1.0\n4.450472 -0.012273 3.025593\n1.595214 4.154773 3.025593\n-0.017913 -0.012273 5.381504\nGa O\n4 6\ndirect\n0.856055 0.856057 0.856055 Ga\n0.643943 0.643944 0.643943 Ga\n0.143944 0.143944 0.143944 Ga\n0.356056 0.356056 0.356056 Ga\n0.749999 0.447134 0.052866 O\n0.447133 0.052867 0.749999 O\n0.052866 0.750000 0.447133 O\n0.250000 0.552867 0.947132 O\n0.947133 0.250001 0.552865 O\n0.552866 0.947133 0.250000 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ga",
"O"
],
"chemical_system": "Ga-O",
"density": 6.228593558043161,
"density_atomic": 0.10005502212479132,
"volume": 99.94500813290242,
"volume_molar": 6.018829072356831,
"formula_full": "Ga4 O6",
"formula_reduced": "Ga2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.95462303,
"spacegroup": 167
},
{
"id": "jvasp-90819",
"created_at": "2022-09-04T14:36:17.218576Z",
"updated_at": "2022-09-04T14:36:17.218599Z",
"structure_string": "Ba4 Al4\n1.0\n0.000000 0.000000 -4.662578\n0.000000 -6.536038 0.000000\n-9.822086 0.000000 0.000000\nBa Al\n4 4\ndirect\n0.757989 0.591045 0.820832 Ba\n0.257989 0.408955 0.179168 Ba\n0.257989 0.091045 0.679168 Ba\n0.757989 0.908955 0.320832 Ba\n0.758011 0.410327 0.474801 Al\n0.258011 0.589673 0.525199 Al\n0.258011 0.910327 0.025199 Al\n0.758011 0.089673 0.974802 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Al"
],
"chemical_system": "Al-Ba",
"density": 3.646068391260266,
"density_atomic": 0.026726714591257396,
"volume": 299.3259786078192,
"volume_molar": 22.532289703762952,
"formula_full": "Ba4 Al4",
"formula_reduced": "BaAl",
"formula_anonymous": "AB",
"energy_above_hull": 0.3681093850000001,
"spacegroup": 62
}
]
}