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=-formula_full&page=874",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=872",
"results": [
{
"id": "jvasp-55397",
"created_at": "2022-09-04T14:38:28.760728Z",
"updated_at": "2022-09-04T14:38:28.760754Z",
"structure_string": "Sr6 Ni2 Pt2 O12\n1.0\n6.707250 0.026011 -0.182319\n-0.188048 6.704664 -0.182319\n0.025193 0.026011 6.709681\nSr Ni Pt O\n6 2 2 12\ndirect\n0.886016 0.250000 0.613983 Sr\n0.386016 0.113983 0.750000 Sr\n0.750000 0.386016 0.113983 Sr\n0.113983 0.749999 0.386017 Sr\n0.613983 0.886016 0.250000 Sr\n0.249999 0.613983 0.886017 Sr\n0.749999 0.749999 0.750000 Ni\n0.250000 0.250000 0.250000 Ni\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.091155 0.288157 0.963451 O\n0.788157 0.591155 0.463451 O\n0.536548 0.211842 0.408845 O\n0.408844 0.536548 0.211842 O\n0.211842 0.408844 0.536548 O\n0.711842 0.036548 0.908845 O\n0.908844 0.711842 0.036548 O\n0.036548 0.908844 0.711842 O\n0.463451 0.788157 0.591155 O\n0.591155 0.463451 0.788157 O\n0.963451 0.091155 0.288157 O\n0.288157 0.963451 0.091155 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Ni",
"Pt",
"O"
],
"chemical_system": "Ni-O-Pt-Sr",
"density": 6.740905321093462,
"density_atomic": 0.07288881021294469,
"volume": 301.82959408621144,
"volume_molar": 8.26209227782195,
"formula_full": "Sr6 Ni2 Pt2 O12",
"formula_reduced": "Sr3NiPtO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.6180048845454544,
"spacegroup": 167
},
{
"id": "jvasp-59573",
"created_at": "2022-09-04T14:37:05.678574Z",
"updated_at": "2022-09-04T14:37:05.678604Z",
"structure_string": "Sr6 Ni2 Ir2 O12\n1.0\n6.696320 0.028220 -0.202586\n-0.209659 6.693097 -0.202586\n0.027235 0.028220 6.699329\nSr Ni Ir O\n6 2 2 12\ndirect\n0.385941 0.114059 0.750000 Sr\n0.885941 0.250001 0.614059 Sr\n0.249999 0.614059 0.885940 Sr\n0.114058 0.750000 0.385941 Sr\n0.614057 0.885942 0.249999 Sr\n0.749999 0.385941 0.114058 Sr\n0.250000 0.249999 0.250000 Ni\n0.750000 0.750000 0.749999 Ni\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.499999 Ir\n0.093339 0.287225 0.963060 O\n0.787224 0.593340 0.463060 O\n0.536938 0.212775 0.406660 O\n0.406660 0.536940 0.212776 O\n0.212776 0.406661 0.536939 O\n0.712776 0.036940 0.906661 O\n0.906661 0.712777 0.036938 O\n0.036939 0.906662 0.712775 O\n0.463060 0.787224 0.593339 O\n0.593338 0.463060 0.787224 O\n0.963060 0.093339 0.287223 O\n0.287223 0.963061 0.093338 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Ni",
"Ir",
"O"
],
"chemical_system": "Ir-Ni-O-Sr",
"density": 6.741874278950239,
"density_atomic": 0.07324204515382235,
"volume": 300.3739171099848,
"volume_molar": 8.222245497585913,
"formula_full": "Sr6 Ni2 Ir2 O12",
"formula_reduced": "Sr3NiIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.83588213,
"spacegroup": 167
},
{
"id": "jvasp-106978",
"created_at": "2022-09-04T14:36:53.347292Z",
"updated_at": "2022-09-04T14:36:53.347318Z",
"structure_string": "Sr6 Nd2\n1.0\n8.064305 -0.000000 0.000000\n-4.032152 6.983894 0.000000\n-0.000000 -0.000000 6.511591\nSr Nd\n6 2\ndirect\n0.828416 0.171584 0.750000 Sr\n0.343169 0.171584 0.750000 Sr\n0.828416 0.656831 0.750000 Sr\n0.171584 0.828415 0.250000 Sr\n0.656832 0.828415 0.250000 Sr\n0.171584 0.343168 0.250000 Sr\n0.666667 0.333333 0.250000 Nd\n0.333334 0.666666 0.750000 Nd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Nd"
],
"chemical_system": "Nd-Sr",
"density": 3.6866391512814247,
"density_atomic": 0.021814149680439817,
"volume": 366.7344415067158,
"volume_molar": 27.60658035366787,
"formula_full": "Sr6 Nd2",
"formula_reduced": "Sr3Nd",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0164751075,
"spacegroup": 194
},
{
"id": "jvasp-111709",
"created_at": "2022-09-04T14:38:41.604521Z",
"updated_at": "2022-09-04T14:38:41.604547Z",
"structure_string": "Sr6 Mn6 O18\n1.0\n5.462476 0.000000 -0.000000\n-2.731238 4.730642 -0.000000\n0.000000 -0.000000 13.483434\nSr Mn O\n6 6 18\ndirect\n0.000000 0.000000 0.250000 Sr\n0.000000 0.000000 0.750000 Sr\n0.333333 0.666667 0.409800 Sr\n0.666667 0.333333 0.590200 Sr\n0.666667 0.333333 0.909800 Sr\n0.333333 0.666667 0.090200 Sr\n0.333333 0.666667 0.843942 Mn\n0.666667 0.333333 0.156058 Mn\n0.666667 0.333333 0.343942 Mn\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.333333 0.666667 0.656058 Mn\n0.164324 0.835676 0.581879 O\n0.835677 0.164324 0.081879 O\n0.671353 0.835676 0.918121 O\n0.164324 0.328647 0.918121 O\n0.164324 0.835676 0.918121 O\n0.671353 0.835676 0.581879 O\n0.164324 0.328647 0.581879 O\n0.328647 0.164324 0.418121 O\n0.972457 0.486228 0.250000 O\n0.835677 0.164324 0.418121 O\n0.027543 0.513772 0.750000 O\n0.486228 0.972456 0.750000 O\n0.486228 0.513772 0.750000 O\n0.835676 0.671353 0.081879 O\n0.513773 0.027543 0.250000 O\n0.513772 0.486228 0.250000 O\n0.835676 0.671353 0.418121 O\n0.328647 0.164324 0.081879 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Sr",
"Mn",
"O"
],
"chemical_system": "Mn-O-Sr",
"density": 5.448957183083405,
"density_atomic": 0.08610157899333425,
"volume": 348.42566594885,
"volume_molar": 6.9942280158023795,
"formula_full": "Sr6 Mn6 O18",
"formula_reduced": "SrMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.822136810275862,
"spacegroup": 194
},
{
"id": "jvasp-22401",
"created_at": "2022-09-04T14:36:50.176253Z",
"updated_at": "2022-09-04T14:36:50.176274Z",
"structure_string": "Sr6 Mn2 N6\n1.0\n3.828586 -6.631307 0.000000\n3.828586 6.631307 -0.000000\n-0.000000 0.000000 5.251895\nSr Mn N\n6 2 6\ndirect\n0.639585 0.727626 0.750001 Sr\n0.911960 0.639585 0.250000 Sr\n0.727626 0.088041 0.250000 Sr\n0.272375 0.911960 0.750001 Sr\n0.088041 0.360416 0.750001 Sr\n0.360416 0.272375 0.250000 Sr\n0.333333 0.666668 0.250000 Mn\n0.666668 0.333333 0.750001 Mn\n0.881850 0.570622 0.750001 N\n0.311230 0.881850 0.250000 N\n0.570622 0.688771 0.250000 N\n0.429379 0.311230 0.750001 N\n0.688771 0.118151 0.750001 N\n0.118151 0.429379 0.250000 N\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Sr",
"Mn",
"N"
],
"chemical_system": "Mn-N-Sr",
"density": 4.481037535319296,
"density_atomic": 0.05249820616607121,
"volume": 266.6757785154188,
"volume_molar": 11.471136253588828,
"formula_full": "Sr6 Mn2 N6",
"formula_reduced": "Sr3MnN3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.800987988768473,
"spacegroup": 176
},
{
"id": "jvasp-22821",
"created_at": "2022-09-04T14:37:33.094809Z",
"updated_at": "2022-09-04T14:37:33.094825Z",
"structure_string": "Sr6 Mg2 Rh2 O12\n1.0\n6.686741 0.001725 -0.304789\n-0.319076 6.679123 -0.304789\n0.001643 0.001725 6.693683\nSr Mg Rh O\n6 2 2 12\ndirect\n0.883373 0.249999 0.616626 Sr\n0.383373 0.116625 0.750000 Sr\n0.750000 0.383373 0.116626 Sr\n0.116626 0.749999 0.383373 Sr\n0.616626 0.883373 0.250000 Sr\n0.249999 0.616625 0.883373 Sr\n0.749999 0.749999 0.749999 Mg\n0.250000 0.250000 0.250000 Mg\n0.499999 0.499999 0.500000 Rh\n0.000000 0.000000 0.000000 Rh\n0.093436 0.287519 0.963229 O\n0.787519 0.593436 0.463229 O\n0.536770 0.212479 0.406563 O\n0.406563 0.536770 0.212480 O\n0.212480 0.406563 0.536770 O\n0.712480 0.036769 0.906563 O\n0.906563 0.712479 0.036770 O\n0.036770 0.906562 0.712480 O\n0.463229 0.787519 0.593436 O\n0.593436 0.463228 0.787519 O\n0.963229 0.093436 0.287519 O\n0.287519 0.963229 0.093436 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Rh",
"O"
],
"chemical_system": "Mg-O-Rh-Sr",
"density": 5.399586413297677,
"density_atomic": 0.07358817558177544,
"volume": 298.96107392351814,
"volume_molar": 8.183571222400872,
"formula_full": "Sr6 Mg2 Rh2 O12",
"formula_reduced": "Sr3MgRhO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.3983183618181816,
"spacegroup": 167
},
{
"id": "jvasp-95938",
"created_at": "2022-09-04T14:35:42.119437Z",
"updated_at": "2022-09-04T14:35:42.119465Z",
"structure_string": "Sr6 Mg2 Pt2 O12\n1.0\n6.716036 0.007834 -0.260179\n-0.270756 6.710580 -0.260179\n0.007515 0.007834 6.721069\nSr Mg Pt O\n6 2 2 12\ndirect\n0.884043 0.249999 0.615958 Sr\n0.384043 0.115957 0.750000 Sr\n0.750000 0.384042 0.115958 Sr\n0.115958 0.750000 0.384042 Sr\n0.615958 0.884042 0.250000 Sr\n0.250000 0.615957 0.884042 Sr\n0.750001 0.749999 0.750000 Mg\n0.250000 0.250000 0.250000 Mg\n0.500000 0.499999 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.094989 0.289463 0.964754 O\n0.789464 0.594988 0.464753 O\n0.535247 0.210536 0.405011 O\n0.405011 0.535246 0.210536 O\n0.210536 0.405011 0.535246 O\n0.710537 0.035246 0.905011 O\n0.905011 0.710536 0.035246 O\n0.035246 0.905011 0.710536 O\n0.464754 0.789463 0.594989 O\n0.594989 0.464753 0.789464 O\n0.964754 0.094988 0.289464 O\n0.289464 0.964753 0.094989 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Pt",
"O"
],
"chemical_system": "Mg-O-Pt-Sr",
"density": 6.3389920768076164,
"density_atomic": 0.07261922504507197,
"volume": 302.95007949128404,
"volume_molar": 8.292763736135008,
"formula_full": "Sr6 Mg2 Pt2 O12",
"formula_reduced": "Sr3MgPtO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.3711436709090907,
"spacegroup": 167
},
{
"id": "jvasp-22415",
"created_at": "2022-09-04T14:37:11.885496Z",
"updated_at": "2022-09-04T14:37:11.885525Z",
"structure_string": "Sr6 Mg2 Ir2 O12\n1.0\n6.713100 0.009713 -0.271692\n-0.283302 6.707126 -0.271692\n0.009299 0.009713 6.718588\nSr Mg Ir O\n6 2 2 12\ndirect\n0.884453 0.249999 0.615547 Sr\n0.384453 0.115546 0.750000 Sr\n0.750000 0.384453 0.115547 Sr\n0.115547 0.750000 0.384454 Sr\n0.615547 0.884453 0.250001 Sr\n0.250000 0.615547 0.884454 Sr\n0.750000 0.750000 0.750001 Mg\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n0.095554 0.288520 0.963869 O\n0.788521 0.595553 0.463869 O\n0.536131 0.211479 0.404447 O\n0.404447 0.536131 0.211480 O\n0.211480 0.404446 0.536132 O\n0.711480 0.036130 0.904447 O\n0.904447 0.711479 0.036132 O\n0.036132 0.904447 0.711480 O\n0.463869 0.788520 0.595554 O\n0.595554 0.463868 0.788521 O\n0.963869 0.095553 0.288521 O\n0.288521 0.963869 0.095554 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Ir",
"O"
],
"chemical_system": "Ir-Mg-O-Sr",
"density": 6.315645172436947,
"density_atomic": 0.07271227883241835,
"volume": 302.562378091655,
"volume_molar": 8.282151043401301,
"formula_full": "Sr6 Mg2 Ir2 O12",
"formula_reduced": "Sr3MgIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.590688189090909,
"spacegroup": 167
},
{
"id": "jvasp-90776",
"created_at": "2022-09-04T14:36:17.437548Z",
"updated_at": "2022-09-04T14:36:17.437566Z",
"structure_string": "Sr6 Mg2\n1.0\n5.548123 0.000000 -0.000000\n0.000000 5.548123 0.000000\n0.000000 0.000000 11.372119\nSr Mg\n6 2\ndirect\n0.500000 0.500000 0.000000 Sr\n0.500000 0.000000 0.250000 Sr\n0.000000 0.500000 0.250000 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.500000 0.750000 Sr\n0.500000 0.000000 0.750000 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.7244387124911267,
"density_atomic": 0.022853695156839625,
"volume": 350.05280087521294,
"volume_molar": 26.350840503784795,
"formula_full": "Sr6 Mg2",
"formula_reduced": "Sr3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0792486764705882,
"spacegroup": 139
},
{
"id": "jvasp-90777",
"created_at": "2022-09-04T14:36:22.222799Z",
"updated_at": "2022-09-04T14:36:22.222828Z",
"structure_string": "Sr6 Mg2\n1.0\n4.340199 0.000000 0.000000\n0.000000 12.880330 0.000000\n0.000000 0.000000 6.366834\nSr Mg\n6 2\ndirect\n0.500000 0.000000 0.916670 Sr\n0.000000 0.282440 0.916654 Sr\n0.500000 0.217560 0.416654 Sr\n0.000000 0.500000 0.416670 Sr\n0.500000 0.782440 0.416654 Sr\n0.000000 0.717560 0.916654 Sr\n0.000000 0.000000 0.416688 Mg\n0.500000 0.500000 0.916688 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.6794795094173054,
"density_atomic": 0.02247655915563956,
"volume": 355.92636509012686,
"volume_molar": 26.792983384598674,
"formula_full": "Sr6 Mg2",
"formula_reduced": "Sr3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0712336764705882,
"spacegroup": 71
},
{
"id": "jvasp-117370",
"created_at": "2022-09-04T14:38:27.091519Z",
"updated_at": "2022-09-04T14:38:27.091542Z",
"structure_string": "Sr6 Mg1 Mo3 O14\n1.0\n10.763560 -0.058028 0.000000\n-9.292300 5.432379 0.000000\n-0.000000 -0.000000 5.572007\nSr Mg Mo O\n6 1 3 14\ndirect\n0.494755 0.505245 -0.000000 Sr\n0.994739 0.005260 0.500000 Sr\n0.687906 0.312094 -0.000000 Sr\n0.188324 0.811676 0.500000 Sr\n0.815290 0.184709 0.500000 Sr\n0.315563 0.684437 -0.000000 Sr\n0.399599 0.600401 0.500000 Mg\n0.904563 0.095436 -0.000000 Mo\n0.097223 0.902777 -0.000000 Mo\n0.595529 0.404471 0.500000 Mo\n0.195568 0.804432 -0.000000 O\n0.695757 0.304243 0.500000 O\n0.300741 0.699259 0.500000 O\n0.806720 0.193280 -0.000000 O\n0.845569 0.652217 0.249886 O\n0.347783 0.154431 0.750114 O\n0.149042 0.339222 0.244032 O\n0.845569 0.652217 0.750114 O\n0.660778 0.850958 0.244032 O\n0.149042 0.339222 0.755969 O\n0.501788 0.498212 0.500000 O\n0.660778 0.850958 0.755969 O\n0.347783 0.154431 0.249886 O\n0.999592 0.000408 -0.000000 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O-Sr",
"density": 5.462264003446845,
"density_atomic": 0.07434934386342833,
"volume": 322.8004277224745,
"volume_molar": 8.099790054720616,
"formula_full": "Sr6 Mg1 Mo3 O14",
"formula_reduced": "Sr6MgMo3O14",
"formula_anonymous": "AB3C6D14",
"energy_above_hull": 2.4041343170833334,
"spacegroup": 38
},
{
"id": "jvasp-27487",
"created_at": "2022-09-04T14:38:16.112948Z",
"updated_at": "2022-09-04T14:38:16.112974Z",
"structure_string": "Sr6 Li2 Ru2 O12\n1.0\n6.703413 -0.006053 -0.272623\n-0.283689 6.697410 -0.272623\n-0.005807 -0.006053 6.708952\nSr Li Ru O\n6 2 2 12\ndirect\n0.890398 0.250001 0.609601 Sr\n0.390399 0.109601 0.750000 Sr\n0.750000 0.390400 0.109601 Sr\n0.109600 0.750000 0.390399 Sr\n0.249999 0.609601 0.890399 Sr\n0.609600 0.890400 0.250000 Sr\n0.250000 0.250000 0.250000 Li\n0.749999 0.750001 0.750000 Li\n0.000000 0.000000 0.000000 Ru\n0.499999 0.500000 0.500000 Ru\n0.219763 0.416188 0.546869 O\n0.083811 0.280237 0.953131 O\n0.953131 0.083812 0.280237 O\n0.546868 0.219764 0.416188 O\n0.583811 0.453132 0.780237 O\n0.780236 0.583812 0.453132 O\n0.719763 0.046869 0.916188 O\n0.916188 0.719764 0.046869 O\n0.046868 0.916188 0.719763 O\n0.453131 0.780237 0.583812 O\n0.416188 0.546869 0.219764 O\n0.280236 0.953132 0.083812 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Li",
"Ru",
"O"
],
"chemical_system": "Li-O-Ru-Sr",
"density": 5.148297493533,
"density_atomic": 0.07304889870279584,
"volume": 301.16812697626585,
"volume_molar": 8.243985695802847,
"formula_full": "Sr6 Li2 Ru2 O12",
"formula_reduced": "Sr3LiRuO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.7522791299999998,
"spacegroup": 167
}
]
}