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=635",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=633",
"results": [
{
"id": "jvasp-59138",
"created_at": "2022-09-04T14:38:35.074065Z",
"updated_at": "2022-09-04T14:38:35.074081Z",
"structure_string": "Sm4 Sc4 O12\n1.0\n5.533312 -0.000000 0.000000\n0.000000 5.802853 0.000000\n0.000000 0.000000 7.994995\nSm Sc O\n4 4 12\ndirect\n0.017353 0.939243 0.250000 Sm\n0.517353 0.560756 0.750000 Sm\n0.482646 0.439244 0.250000 Sm\n0.982646 0.060756 0.750000 Sm\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.000000 0.500000 0.500000 Sc\n0.805538 0.803227 0.938658 O\n0.305538 0.696772 0.061343 O\n0.305538 0.696772 0.438657 O\n0.805538 0.803227 0.561343 O\n0.194462 0.196773 0.061343 O\n0.382658 0.953905 0.750000 O\n0.117342 0.453905 0.750000 O\n0.617342 0.046095 0.250000 O\n0.194462 0.196773 0.438657 O\n0.882658 0.546094 0.250000 O\n0.694462 0.303227 0.938658 O\n0.694462 0.303227 0.561343 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sm",
"Sc",
"O"
],
"chemical_system": "O-Sc-Sm",
"density": 6.29551789485096,
"density_atomic": 0.07790854098300945,
"volume": 256.7112635874116,
"volume_molar": 7.729756820004277,
"formula_full": "Sm4 Sc4 O12",
"formula_reduced": "SmScO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.663906925,
"spacegroup": 62
},
{
"id": "jvasp-22384",
"created_at": "2022-09-04T14:38:35.067452Z",
"updated_at": "2022-09-04T14:38:35.067468Z",
"structure_string": "Ta6 Sn2 S12\n1.0\n2.903193 -5.028479 0.000000\n2.903193 5.028479 -0.000000\n0.000000 -0.000000 14.645955\nTa Sn S\n6 2 12\ndirect\n0.333332 0.666667 0.250000 Ta\n0.666667 0.333332 0.750000 Ta\n0.666667 0.333332 0.250000 Ta\n0.333332 0.666667 0.750000 Ta\n0.000000 0.000000 0.250000 Ta\n0.000000 0.000000 0.750000 Ta\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n-0.000000 0.336578 0.357017 S\n0.336578 0.336578 0.857016 S\n-0.000000 0.663421 0.857016 S\n-0.000000 0.663421 0.642983 S\n0.663421 -0.000000 0.642983 S\n-0.000000 0.336578 0.142983 S\n0.336578 0.336578 0.642983 S\n0.663421 0.663421 0.142983 S\n0.336578 -0.000000 0.357017 S\n0.336578 -0.000000 0.142983 S\n0.663421 0.663421 0.357017 S\n0.663421 -0.000000 0.857016 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ta",
"Sn",
"S"
],
"chemical_system": "S-Sn-Ta",
"density": 6.632054120174787,
"density_atomic": 0.04677025693807221,
"volume": 427.6221964416765,
"volume_molar": 12.876005295360736,
"formula_full": "Ta6 Sn2 S12",
"formula_reduced": "Ta3SnS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.71628693,
"spacegroup": 193
},
{
"id": "jvasp-4990",
"created_at": "2022-09-04T14:38:35.066927Z",
"updated_at": "2022-09-04T14:38:35.066951Z",
"structure_string": "Sc4 In2 C2\n1.0\n1.674074 -2.899580 0.000000\n1.674074 2.899580 0.000000\n0.000000 0.000000 15.262105\nSc In C\n4 2 2\ndirect\n0.333332 0.666666 0.080239 Sc\n0.333332 0.666666 0.419762 Sc\n0.666666 0.333332 0.580239 Sc\n0.666666 0.333332 0.919762 Sc\n0.333332 0.666666 0.750000 In\n0.666666 0.333332 0.250000 In\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sc",
"In",
"C"
],
"chemical_system": "C-In-Sc",
"density": 4.858084141012965,
"density_atomic": 0.05399279468608101,
"volume": 148.16791845120676,
"volume_molar": 11.153600762867104,
"formula_full": "Sc4 In2 C2",
"formula_reduced": "Sc2InC",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5247001175,
"spacegroup": 194
},
{
"id": "jvasp-19354",
"created_at": "2022-09-04T14:38:35.062099Z",
"updated_at": "2022-09-04T14:38:35.062119Z",
"structure_string": "Zn4 Bi4 O12\n1.0\n5.597291 0.000081 0.000905\n-0.000154 5.656353 -0.003111\n-0.001346 -0.222056 8.388373\nZn Bi O\n4 4 12\ndirect\n0.982193 0.976261 0.755138 Zn\n0.517807 0.476268 0.255134 Zn\n0.482193 0.523731 0.744866 Zn\n0.017806 0.023737 0.244861 Zn\n0.000000 0.500000 0.000000 Bi\n0.500000 -0.000000 -0.000000 Bi\n0.500000 -0.000000 0.500000 Bi\n-0.000000 0.499999 0.500000 Bi\n0.857216 0.834955 0.070463 O\n0.668800 0.361613 0.910427 O\n0.331200 0.638386 0.089572 O\n0.142784 0.165044 0.929536 O\n0.831194 0.861612 0.410424 O\n0.133106 0.637560 0.766310 O\n0.633105 0.862434 0.733687 O\n0.866894 0.362439 0.233689 O\n0.357215 0.665043 0.429529 O\n0.366895 0.137564 0.266312 O\n0.642785 0.334956 0.570470 O\n0.168806 0.138387 0.589575 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Zn",
"Bi",
"O"
],
"chemical_system": "Bi-O-Zn",
"density": 8.063091808015223,
"density_atomic": 0.07530853209839779,
"volume": 265.57415797014994,
"volume_molar": 7.9966248075735935,
"formula_full": "Zn4 Bi4 O12",
"formula_reduced": "ZnBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.1465110399999996,
"spacegroup": 14
},
{
"id": "jvasp-58577",
"created_at": "2022-09-04T14:38:35.056992Z",
"updated_at": "2022-09-04T14:38:35.057021Z",
"structure_string": "Mg2 Ni4 O8\n1.0\n2.892190 -0.000000 -0.000000\n-1.446094 4.690484 0.000000\n-0.000000 -0.000000 9.295635\nMg Ni O\n2 4 8\ndirect\n0.392129 0.784255 0.750000 Mg\n0.607873 0.215745 0.250000 Mg\n0.865540 0.731079 0.070588 Ni\n0.134461 0.268920 0.929412 Ni\n0.865540 0.731079 0.429412 Ni\n0.134461 0.268920 0.570588 Ni\n0.225293 0.450586 0.387874 O\n0.774709 0.549413 0.612127 O\n0.774709 0.549413 0.887874 O\n0.225293 0.450586 0.112127 O\n0.957256 0.914510 0.250000 O\n0.042745 0.085490 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Ni",
"O"
],
"chemical_system": "Mg-Ni-O",
"density": 5.417107611089573,
"density_atomic": 0.11102083622260403,
"volume": 126.10245496556237,
"volume_molar": 5.424333814172697,
"formula_full": "Mg2 Ni4 O8",
"formula_reduced": "Mg(NiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.561295407142857,
"spacegroup": 63
},
{
"id": "jvasp-58951",
"created_at": "2022-09-04T14:38:35.054278Z",
"updated_at": "2022-09-04T14:38:35.054303Z",
"structure_string": "Ta6 Se2 I14\n1.0\n3.807006 -6.593927 0.000000\n3.807006 6.593927 -0.000000\n-0.000000 0.000000 13.744327\nTa Se I\n6 2 14\ndirect\n0.129531 0.870470 0.750260 Ta\n0.259062 0.129531 0.250260 Ta\n0.870470 0.740939 0.250260 Ta\n0.129531 0.259062 0.750260 Ta\n0.740939 0.870470 0.750260 Ta\n0.870470 0.129531 0.250260 Ta\n0.000000 0.000000 0.888516 Se\n0.000000 0.000000 0.388515 Se\n0.830926 0.661852 0.614310 I\n0.169075 0.338149 0.114310 I\n0.661852 0.830926 0.114310 I\n0.830926 0.169075 0.614310 I\n0.666668 0.333334 0.144112 I\n0.333334 0.666668 0.644112 I\n0.994688 0.497345 0.863389 I\n0.005313 0.502657 0.363389 I\n0.497344 0.502657 0.363389 I\n0.338149 0.169075 0.614310 I\n0.502657 0.005313 0.863389 I\n0.497345 0.994688 0.363389 I\n0.502657 0.497344 0.863389 I\n0.169075 0.830926 0.114310 I\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ta",
"Se",
"I"
],
"chemical_system": "I-Se-Ta",
"density": 7.267979191355699,
"density_atomic": 0.0318817028626989,
"volume": 690.050970449877,
"volume_molar": 18.889018525562545,
"formula_full": "Ta6 Se2 I14",
"formula_reduced": "Ta3SeI7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.0747413537878785,
"spacegroup": 186
},
{
"id": "jvasp-23065",
"created_at": "2022-09-04T14:38:35.049462Z",
"updated_at": "2022-09-04T14:38:35.049490Z",
"structure_string": "Sc6 Sn6 Pt6\n1.0\n3.727322 -6.455910 -0.000000\n3.727322 6.455910 -0.000000\n0.000000 0.000000 7.371879\nSc Sn Pt\n6 6 6\ndirect\n0.981764 0.596267 0.750000 Sc\n0.403733 0.385497 0.750000 Sc\n0.614502 0.018236 0.750000 Sc\n0.018236 0.614502 0.250000 Sc\n0.385497 0.403733 0.250000 Sc\n0.596267 0.981764 0.250000 Sc\n-0.000000 0.274404 0.000000 Sn\n0.725596 0.725596 0.500000 Sn\n-0.000000 0.274404 0.500000 Sn\n0.274404 -0.000000 0.500000 Sn\n0.274404 -0.000000 0.000000 Sn\n0.725596 0.725596 0.000000 Sn\n0.000000 0.000000 0.250000 Pt\n0.000000 0.000000 0.750000 Pt\n0.666667 0.333333 0.036832 Pt\n0.333333 0.666667 0.536832 Pt\n0.333333 0.666667 0.963168 Pt\n0.666667 0.333333 0.463168 Pt\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sc",
"Sn",
"Pt"
],
"chemical_system": "Pt-Sc-Sn",
"density": 10.074640946329417,
"density_atomic": 0.05073526477092649,
"volume": 354.78281391200665,
"volume_molar": 11.869733581149946,
"formula_full": "Sc6 Sn6 Pt6",
"formula_reduced": "ScSnPt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3328027833333331,
"spacegroup": 190
},
{
"id": "jvasp-55209",
"created_at": "2022-09-04T14:38:35.049453Z",
"updated_at": "2022-09-04T14:38:35.049484Z",
"structure_string": "Ni12 Mo12 N4\n1.0\n6.756159 0.000000 3.900671\n2.252052 6.369768 3.900671\n-0.000000 -0.000000 7.801340\nNi Mo N\n12 12 4\ndirect\n0.630332 0.289889 0.289889 Ni\n0.500000 0.500000 0.500000 Ni\n-0.000000 0.500000 0.500000 Ni\n0.289889 0.630332 0.289889 Ni\n0.710110 0.710111 0.710111 Ni\n0.289889 0.289889 0.289889 Ni\n0.500000 -0.000000 0.500000 Ni\n0.710110 0.710111 0.369668 Ni\n0.289889 0.289889 0.630332 Ni\n0.500000 0.500000 -0.000000 Ni\n0.710111 0.369668 0.710111 Ni\n0.369668 0.710111 0.710111 Ni\n0.671161 0.671161 0.078839 Mo\n0.078839 0.671161 0.078839 Mo\n0.921161 0.328839 0.921161 Mo\n0.921161 0.328839 0.328839 Mo\n0.078839 0.078839 0.671161 Mo\n0.671161 0.078839 0.671161 Mo\n0.078839 0.671161 0.671161 Mo\n0.921161 0.921161 0.328839 Mo\n0.328839 0.921161 0.921161 Mo\n0.328839 0.921161 0.328839 Mo\n0.328839 0.328839 0.921161 Mo\n0.671161 0.078839 0.078839 Mo\n0.500000 -0.000000 -0.000000 N\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n-0.000000 0.500000 -0.000000 N\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ni",
"Mo",
"N"
],
"chemical_system": "Mo-N-Ni",
"density": 9.454960250400342,
"density_atomic": 0.08339986526550433,
"volume": 335.73195725031104,
"volume_molar": 7.220803943541698,
"formula_full": "Ni12 Mo12 N4",
"formula_reduced": "Ni3Mo3N",
"formula_anonymous": "AB3C3",
"energy_above_hull": 4.241782592857143,
"spacegroup": 227
},
{
"id": "jvasp-27059",
"created_at": "2022-09-04T14:38:35.049112Z",
"updated_at": "2022-09-04T14:38:35.049137Z",
"structure_string": "Ho4 Co4 Si4\n1.0\n4.183350 -0.000000 0.000000\n0.000000 6.869319 0.000000\n0.000000 0.000000 6.863321\nHo Co Si\n4 4 4\ndirect\n0.250000 0.188106 0.982028 Ho\n0.750000 0.811894 0.017972 Ho\n0.250000 0.311894 0.482028 Ho\n0.750000 0.688106 0.517972 Ho\n0.250000 0.567901 0.148028 Co\n0.750000 0.432099 0.851972 Co\n0.250000 0.932100 0.648028 Co\n0.750000 0.067901 0.351972 Co\n0.250000 0.605353 0.804718 Si\n0.750000 0.394647 0.195282 Si\n0.250000 0.894647 0.304718 Si\n0.750000 0.105353 0.695281 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ho",
"Co",
"Si"
],
"chemical_system": "Co-Ho-Si",
"density": 8.484955246704093,
"density_atomic": 0.06084277986434376,
"volume": 197.22964707982496,
"volume_molar": 9.897872472998575,
"formula_full": "Ho4 Co4 Si4",
"formula_reduced": "HoCoSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.069345022222222,
"spacegroup": 62
},
{
"id": "jvasp-54631",
"created_at": "2022-09-04T14:38:35.048073Z",
"updated_at": "2022-09-04T14:38:35.048095Z",
"structure_string": "Ca3 Cd3 Pb3\n1.0\n3.925319 -6.798851 0.000000\n3.925319 6.798851 -0.000000\n-0.000000 -0.000000 4.721859\nCa Cd Pb\n3 3 3\ndirect\n0.424301 0.424301 0.500000 Ca\n0.000000 0.575699 0.500000 Ca\n0.575699 0.000000 0.500000 Ca\n0.000000 0.252169 0.000000 Cd\n0.252169 0.000000 0.000000 Cd\n0.747831 0.747831 0.000000 Cd\n0.000000 0.000000 0.500000 Pb\n0.666667 0.333333 0.000000 Pb\n0.333333 0.666667 0.000000 Pb\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ca",
"Cd",
"Pb"
],
"chemical_system": "Ca-Cd-Pb",
"density": 7.109581197304483,
"density_atomic": 0.03570993168788552,
"volume": 252.03072575614087,
"volume_molar": 16.864050070538195,
"formula_full": "Ca3 Cd3 Pb3",
"formula_reduced": "CaCdPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-26865",
"created_at": "2022-09-04T14:38:35.047734Z",
"updated_at": "2022-09-04T14:38:35.047758Z",
"structure_string": "Ce2 Te4\n1.0\n4.540386 0.000000 0.000000\n0.000000 4.540386 0.000000\n-0.000000 0.000000 8.946223\nCe Te\n2 4\ndirect\n0.000000 0.500000 0.731228 Ce\n0.500000 0.000000 0.268772 Ce\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.000000 Te\n0.000000 0.500000 0.366238 Te\n0.500000 0.000000 0.633762 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Te"
],
"chemical_system": "Ce-Te",
"density": 7.118659400339791,
"density_atomic": 0.03253313977640031,
"volume": 184.42732675781966,
"volume_molar": 18.510788695435075,
"formula_full": "Ce2 Te4",
"formula_reduced": "CeTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7635403444444446,
"spacegroup": 129
},
{
"id": "jvasp-59219",
"created_at": "2022-09-04T14:38:35.046865Z",
"updated_at": "2022-09-04T14:38:35.046890Z",
"structure_string": "Li2 V2 P4 O14\n1.0\n5.036518 0.018376 0.019147\n0.306683 6.715258 0.008112\n0.399104 2.978088 7.617257\nLi V P O\n2 2 4 14\ndirect\n0.280323 0.819514 -0.003796 Li\n0.790361 0.184794 0.435432 Li\n0.240135 0.219068 0.727376 V\n0.758881 0.796679 0.273071 V\n0.233661 0.115195 0.172892 P\n0.285960 0.459265 0.305300 P\n0.715182 0.541445 0.691211 P\n0.766484 0.890237 0.829129 P\n0.825095 0.707025 0.520320 O\n0.700253 0.657474 0.832283 O\n0.945625 0.073520 0.246468 O\n0.592095 0.055958 0.691674 O\n0.576667 0.496981 0.327442 O\n0.430718 0.479908 0.681681 O\n0.151660 0.297224 0.469387 O\n0.268745 0.113798 0.988242 O\n0.290588 0.356636 0.154201 O\n0.901209 0.348297 0.768039 O\n0.120159 0.666134 0.222044 O\n0.435292 0.966510 0.296811 O\n0.064083 0.926213 0.786381 O\n0.683613 0.862153 0.018315 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"V",
"P",
"O"
],
"chemical_system": "Li-O-P-V",
"density": 2.9907749458209905,
"density_atomic": 0.08546051574730304,
"volume": 257.42882321294996,
"volume_molar": 7.046693677588819,
"formula_full": "Li2 V2 P4 O14",
"formula_reduced": "LiVP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.853054518181818,
"spacegroup": 1
}
]
}