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=energy_above_hull&page=377",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=375",
"results": [
{
"id": "jvasp-29961",
"created_at": "2022-09-04T14:38:01.871251Z",
"updated_at": "2022-09-04T14:38:01.871278Z",
"structure_string": "Nd1 Pb8 F19\n1.0\n3.584819 -0.000754 2.068196\n1.193886 3.375749 2.068213\n-0.522789 -0.350539 38.104091\nNd Pb F\n1 8 19\ndirect\n0.058719 0.030704 0.875218 Nd\n0.032376 0.011766 0.660332 Pb\n0.032276 0.015126 0.548547 Pb\n0.031316 0.017245 0.437122 Pb\n0.034265 0.010944 0.771374 Pb\n0.031814 0.022144 0.213851 Pb\n0.028862 0.019689 0.103639 Pb\n0.015816 0.007409 0.996853 Pb\n0.030652 0.019063 0.325724 Pb\n0.781038 0.764878 0.520990 F\n0.736606 0.711952 0.870844 F\n0.504968 0.479110 0.837187 F\n0.263658 0.251340 0.915038 F\n0.788942 0.766191 0.741924 F\n0.281359 0.256571 0.800400 F\n0.779903 0.760270 0.633192 F\n0.272682 0.250932 0.691566 F\n0.276706 0.266227 0.243481 F\n0.780208 0.767077 0.409532 F\n0.275004 0.259936 0.467198 F\n0.778014 0.767287 0.298662 F\n0.432326 0.426760 0.968585 F\n0.274174 0.261691 0.355833 F\n0.785877 0.776924 0.184587 F\n0.761839 0.753715 0.081365 F\n0.267617 0.258400 0.135185 F\n0.276951 0.258748 0.578305 F\n0.588034 0.581905 0.027911 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Nd",
"Pb",
"F"
],
"chemical_system": "F-Nd-Pb",
"density": 7.698129981495054,
"density_atomic": 0.060017164204392515,
"volume": 466.5332054784212,
"volume_molar": 10.034030830732341,
"formula_full": "Nd1 Pb8 F19",
"formula_reduced": "NdPb8F19",
"formula_anonymous": "AB8C19",
"energy_above_hull": 1.2692857142559966e-06,
"spacegroup": 156
},
{
"id": "jvasp-972",
"created_at": "2022-09-04T14:37:41.793349Z",
"updated_at": "2022-09-04T14:37:41.793366Z",
"structure_string": "Pt1\n1.0\n2.435265 0.000000 1.406001\n0.811755 2.295990 1.406001\n0.000000 0.000000 2.812002\nPt\n1\ndirect\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pt"
],
"chemical_system": "Pt",
"density": 20.603400504227608,
"density_atomic": 0.06360161674662804,
"volume": 15.722870756316377,
"volume_molar": 9.468534084582489,
"formula_full": "Pt1",
"formula_reduced": "Pt",
"formula_anonymous": "A",
"energy_above_hull": 1.3999999999292356e-06,
"spacegroup": 225
},
{
"id": "jvasp-14607",
"created_at": "2022-09-04T14:37:14.412635Z",
"updated_at": "2022-09-04T14:37:14.412658Z",
"structure_string": "Pt1\n1.0\n2.435265 0.000000 1.406001\n0.811755 2.295990 1.406001\n0.000000 0.000000 2.812002\nPt\n1\ndirect\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pt"
],
"chemical_system": "Pt",
"density": 20.603400504227608,
"density_atomic": 0.06360161674662804,
"volume": 15.722870756316377,
"volume_molar": 9.468534084582489,
"formula_full": "Pt1",
"formula_reduced": "Pt",
"formula_anonymous": "A",
"energy_above_hull": 1.3999999999292356e-06,
"spacegroup": 225
},
{
"id": "jvasp-1002",
"created_at": "2022-09-04T14:37:42.447438Z",
"updated_at": "2022-09-04T14:37:42.447468Z",
"structure_string": "Si2\n1.0\n3.364150 -0.000000 1.942293\n1.121383 3.171752 1.942293\n-0.000000 -0.000000 3.884586\nSi\n2\ndirect\n0.874999 0.875000 0.875000 Si\n0.125000 0.125000 0.125000 Si\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.2503078658459854,
"density_atomic": 0.04825148466697366,
"volume": 41.44950178846881,
"volume_molar": 12.480736710101546,
"formula_full": "Si2",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy_above_hull": 1.4000000003733248e-06,
"spacegroup": 227
},
{
"id": "jvasp-86179",
"created_at": "2022-09-04T14:36:20.184572Z",
"updated_at": "2022-09-04T14:36:20.184582Z",
"structure_string": "Rb4 Fe2 I8\n1.0\n7.108478 0.000000 -2.587085\n0.000000 8.012385 0.000000\n0.039114 0.000000 10.326381\nRb Fe I\n4 2 8\ndirect\n0.198949 0.744541 0.037342 Rb\n0.297531 0.744596 0.587804 Rb\n0.702468 0.244596 0.412196 Rb\n0.801050 0.244541 0.962658 Rb\n0.801817 0.743867 0.214277 Fe\n0.198183 0.243867 0.785723 Fe\n0.632296 0.743586 0.945056 I\n0.582124 0.743757 0.362247 I\n0.029149 0.488053 0.279924 I\n0.367704 0.243586 0.054944 I\n0.971721 0.500298 0.720372 I\n0.417875 0.243757 0.637753 I\n0.970851 0.988053 0.720076 I\n0.028279 0.000298 0.279629 I\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"Fe",
"I"
],
"chemical_system": "Fe-I-Rb",
"density": 4.1411981043940775,
"density_atomic": 0.023770766159302584,
"volume": 588.958719553983,
"volume_molar": 25.334230792738925,
"formula_full": "Rb4 Fe2 I8",
"formula_reduced": "Rb2FeI4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4285714285411366e-06,
"spacegroup": 11
},
{
"id": "jvasp-11616",
"created_at": "2022-09-04T14:37:28.338392Z",
"updated_at": "2022-09-04T14:37:28.338425Z",
"structure_string": "Ca2 Ti2 F10\n1.0\n5.303656 0.016153 1.920978\n1.149965 5.177509 1.920978\n-0.003666 -0.002951 7.718675\nCa Ti F\n2 2 10\ndirect\n0.456772 0.543228 0.750001 Ca\n0.543229 0.456771 0.250000 Ca\n0.000000 0.000000 0.000000 Ti\n-0.000000 0.000000 0.500000 Ti\n0.204798 0.255058 0.879569 F\n0.744943 0.795201 0.620432 F\n0.795203 0.744942 0.120432 F\n0.255058 0.204799 0.379569 F\n0.093184 0.906816 0.750001 F\n0.906817 0.093183 0.250000 F\n0.286342 0.684824 0.469672 F\n0.315176 0.713658 0.030329 F\n0.713659 0.315175 0.530329 F\n0.684824 0.286342 0.969672 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Ti",
"F"
],
"chemical_system": "Ca-F-Ti",
"density": 2.867561959927658,
"density_atomic": 0.06607849794965232,
"volume": 211.8692227336512,
"volume_molar": 9.113616300098853,
"formula_full": "Ca2 Ti2 F10",
"formula_reduced": "CaTiF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 1.4285714285966478e-06,
"spacegroup": 15
},
{
"id": "jvasp-14599",
"created_at": "2022-09-04T14:36:15.603381Z",
"updated_at": "2022-09-04T14:36:15.603417Z",
"structure_string": "Tc2\n1.0\n1.378398 -2.387456 -0.000000\n1.378398 2.387456 0.000000\n-0.000000 0.000000 4.398881\nTc\n2\ndirect\n0.333334 0.666668 0.750000 Tc\n0.666668 0.333334 0.250000 Tc\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.241465940161442,
"density_atomic": 0.06907927577938042,
"volume": 28.95224330937446,
"volume_molar": 8.71772422634106,
"formula_full": "Tc2",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"energy_above_hull": 1.4999999997655775e-06,
"spacegroup": 194
},
{
"id": "jvasp-14605",
"created_at": "2022-09-04T14:37:10.668753Z",
"updated_at": "2022-09-04T14:37:10.668778Z",
"structure_string": "Nd4\n1.0\n1.835360 -3.178937 0.000000\n1.835360 3.178937 -0.000000\n-0.000000 -0.000000 11.819199\nNd\n4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Nd\n0.333333 0.666667 0.250000 Nd\n0.666667 0.333333 0.750000 Nd\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Nd"
],
"chemical_system": "Nd",
"density": 6.946716895237449,
"density_atomic": 0.02900272249237189,
"volume": 137.91808686415746,
"volume_molar": 20.764053311146583,
"formula_full": "Nd4",
"formula_reduced": "Nd",
"formula_anonymous": "A",
"energy_above_hull": 1.500000000209667e-06,
"spacegroup": 194
},
{
"id": "jvasp-937",
"created_at": "2022-09-04T14:37:39.394587Z",
"updated_at": "2022-09-04T14:37:39.394615Z",
"structure_string": "Nd4\n1.0\n1.835422 -3.179043 0.000000\n1.835422 3.179043 0.000000\n0.000000 0.000000 11.818027\nNd\n4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Nd\n0.333333 0.666666 0.250000 Nd\n0.666666 0.333333 0.750000 Nd\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Nd"
],
"chemical_system": "Nd",
"density": 6.94693948148439,
"density_atomic": 0.029003651795702946,
"volume": 137.91366784346178,
"volume_molar": 20.763388012030312,
"formula_full": "Nd4",
"formula_reduced": "Nd",
"formula_anonymous": "A",
"energy_above_hull": 1.500000000209667e-06,
"spacegroup": 194
},
{
"id": "jvasp-1017",
"created_at": "2022-09-04T14:37:45.854841Z",
"updated_at": "2022-09-04T14:37:45.854868Z",
"structure_string": "Tb3\n1.0\n3.470030 -0.002490 8.034836\n1.658873 3.047828 8.034836\n-0.004192 -0.002490 8.752124\nTb\n3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.222226 0.222226 0.222226 Tb\n0.777773 0.777774 0.777774 Tb\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Tb"
],
"chemical_system": "Tb",
"density": 8.53700390577571,
"density_atomic": 0.03234917475847476,
"volume": 92.73806897389453,
"volume_molar": 18.616056839046053,
"formula_full": "Tb3",
"formula_reduced": "Tb",
"formula_anonymous": "A",
"energy_above_hull": 1.600000000046009e-06,
"spacegroup": 166
},
{
"id": "jvasp-1029",
"created_at": "2022-09-04T14:37:48.719798Z",
"updated_at": "2022-09-04T14:37:48.719819Z",
"structure_string": "Ti3\n1.0\n2.273420 -3.937680 0.000000\n2.273420 3.937680 0.000000\n0.000000 0.000000 2.820165\nTi\n3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.500001 Ti\n0.666667 0.333333 0.500001 Ti\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Ti"
],
"chemical_system": "Ti",
"density": 4.722608576696943,
"density_atomic": 0.059415074295611964,
"volume": 50.49223678613765,
"volume_molar": 10.135711907112366,
"formula_full": "Ti3",
"formula_reduced": "Ti",
"formula_anonymous": "A",
"energy_above_hull": 1.66666666689963e-06,
"spacegroup": 191
},
{
"id": "jvasp-1008",
"created_at": "2022-09-04T14:37:49.573712Z",
"updated_at": "2022-09-04T14:37:49.573733Z",
"structure_string": "Sn2\n1.0\n4.062378 -0.000000 2.345415\n1.354126 3.830046 2.345415\n0.000000 0.000000 4.690830\nSn\n2\ndirect\n0.875001 0.875001 0.874997 Sn\n0.125000 0.125000 0.125000 Sn\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Sn"
],
"chemical_system": "Sn",
"density": 5.401723904034379,
"density_atomic": 0.027402865561446735,
"volume": 72.9850677665555,
"volume_molar": 21.976317573416804,
"formula_full": "Sn2",
"formula_reduced": "Sn",
"formula_anonymous": "A",
"energy_above_hull": 1.6999999999933737e-06,
"spacegroup": 227
}
]
}