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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=995",
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"results": [
{
"id": "jvasp-119674",
"created_at": "2022-09-04T14:38:50.312895Z",
"updated_at": "2022-09-04T14:38:50.312922Z",
"structure_string": "Sr8 Ir4 N12\n1.0\n6.277851 -0.006036 -0.265573\n-10.168749 4.932735 -0.000000\n-0.009123 -0.018806 12.460999\nSr Ir N\n8 4 12\ndirect\n0.440080 0.020176 0.855744 Sr\n0.559916 0.580094 0.644256 Sr\n0.559916 0.979821 0.144256 Sr\n0.440080 0.419903 0.355744 Sr\n0.533123 0.874790 0.575517 Sr\n0.466872 0.341665 0.924483 Sr\n0.466873 0.125207 0.424483 Sr\n0.533124 0.658333 0.075517 Sr\n0.408866 0.709669 0.332172 Ir\n0.591130 0.300802 0.167829 Ir\n0.591130 0.290328 0.667829 Ir\n0.408866 0.699196 0.832172 Ir\n-0.000001 0.000514 0.750000 N\n-0.000002 0.619506 0.750000 N\n-0.000001 0.380493 0.250000 N\n0.585485 0.123484 0.632909 N\n0.414512 0.537997 0.867091 N\n0.414511 0.876513 0.367091 N\n0.585485 0.462000 0.132909 N\n0.506212 0.158022 0.041940 N\n0.493785 0.651808 0.458060 N\n0.493784 0.841976 0.958060 N\n0.506211 0.348190 0.541940 N\n-0.000002 0.999484 0.250000 N\n",
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"formula_full": "Sr8 Ir4 N12",
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{
"id": "jvasp-78502",
"created_at": "2022-09-04T14:37:10.141969Z",
"updated_at": "2022-09-04T14:37:10.141988Z",
"structure_string": "Sr2 Ir1\n1.0\n-3.609578 -3.609578 -0.000000\n-3.609578 0.000000 -3.609578\n0.000000 -3.609578 -3.609578\nSr Ir\n2 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 3,
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"elements": [
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"density": 6.487185756392199,
"density_atomic": 0.03189495296709127,
"volume": 94.05876857994913,
"volume_molar": 18.881171470023965,
"formula_full": "Sr2 Ir1",
"formula_reduced": "Sr2Ir",
"formula_anonymous": "AB2",
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"spacegroup": 225
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{
"id": "jvasp-91306",
"created_at": "2022-09-04T14:36:08.658588Z",
"updated_at": "2022-09-04T14:36:08.658614Z",
"structure_string": "Sr4 In2 Sb2 O12\n1.0\n5.778075 0.000000 -0.005173\n0.000000 5.815479 0.000000\n0.018947 0.000000 8.176388\nSr In Sb O\n4 2 2 12\ndirect\n0.007414 0.034980 0.749870 Sr\n0.492587 0.534980 0.750130 Sr\n0.992586 0.965020 0.250130 Sr\n0.507413 0.465020 0.249870 Sr\n0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.000000 In\n0.500000 0.000000 0.500000 Sb\n0.000000 0.500000 0.000000 Sb\n0.222264 0.796966 0.539053 O\n0.200419 0.777883 0.958573 O\n0.423694 0.019954 0.260082 O\n0.076306 0.519954 0.239918 O\n0.576305 0.980046 0.739919 O\n0.722263 0.703034 0.039053 O\n0.299581 0.277883 0.541428 O\n0.923694 0.480046 0.760082 O\n0.799581 0.222117 0.041428 O\n0.700418 0.722117 0.458573 O\n0.277736 0.296966 0.960948 O\n0.777736 0.203034 0.460948 O\n",
"nsites": 20,
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"elements": [
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],
"chemical_system": "In-O-Sb-Sr",
"density": 6.138369755163918,
"density_atomic": 0.07279456178339676,
"volume": 274.7457984500385,
"volume_molar": 8.272789357423607,
"formula_full": "Sr4 In2 Sb2 O12",
"formula_reduced": "Sr2InSbO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.494190969,
"spacegroup": 14
},
{
"id": "jvasp-101633",
"created_at": "2022-09-04T14:36:46.264284Z",
"updated_at": "2022-09-04T14:36:46.264294Z",
"structure_string": "Sr2 In1 Re1 O6\n1.0\n5.005759 -0.000000 2.890076\n1.668586 4.719475 2.890076\n-0.000000 -0.000000 5.780153\nSr In Re O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750001 0.750000 Sr\n0.500000 0.500001 0.500000 In\n0.000000 0.000000 0.000000 Re\n0.759133 0.240868 0.240868 O\n0.240868 0.759133 0.759132 O\n0.240868 0.759133 0.240868 O\n0.759133 0.240868 0.759132 O\n0.240868 0.240868 0.759132 O\n0.759133 0.759133 0.240868 O\n",
"nsites": 10,
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"elements": [
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"chemical_system": "In-O-Re-Sr",
"density": 6.958899899411274,
"density_atomic": 0.07323134977037916,
"volume": 136.55353931554637,
"volume_molar": 8.223446350344144,
"formula_full": "Sr2 In1 Re1 O6",
"formula_reduced": "Sr2InReO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.139365159,
"spacegroup": 225
},
{
"id": "jvasp-87922",
"created_at": "2022-09-04T14:36:13.614956Z",
"updated_at": "2022-09-04T14:36:13.614983Z",
"structure_string": "Sr4 In2 Pt4\n1.0\n5.898054 0.045677 1.213688\n2.822536 5.179036 1.213688\n0.050517 0.030267 8.360393\nSr In Pt\n4 2 4\ndirect\n0.496993 0.208014 0.647162 Sr\n0.791986 0.503008 0.852838 Sr\n0.503006 0.791988 0.352838 Sr\n0.208013 0.496994 0.147162 Sr\n0.141628 0.858373 0.750000 In\n0.858371 0.141629 0.250000 In\n0.723211 0.000251 0.001705 Pt\n0.999749 0.276789 0.498296 Pt\n0.276789 0.999751 0.998295 Pt\n0.000251 0.723213 0.501704 Pt\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "In-Pt-Sr",
"density": 8.898481518954801,
"density_atomic": 0.03938978242225618,
"volume": 253.87294331308004,
"volume_molar": 15.288585997868688,
"formula_full": "Sr4 In2 Pt4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 15
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{
"id": "jvasp-23492",
"created_at": "2022-09-04T14:37:35.017374Z",
"updated_at": "2022-09-04T14:37:35.017393Z",
"structure_string": "Sr4 In2 Pd4\n1.0\n6.021780 -0.000000 -0.000000\n-3.010890 5.123703 -1.267241\n-0.000000 -0.030061 8.365263\nSr In Pd\n4 2 4\ndirect\n0.209140 0.704144 0.352595 Sr\n0.504995 0.295855 0.147404 Sr\n0.790860 0.295855 0.647404 Sr\n0.495005 0.704144 0.852595 Sr\n0.858555 0.000000 0.250000 In\n0.141445 0.000000 0.750000 In\n0.998250 0.271228 0.002485 Pd\n0.727021 0.728772 0.497515 Pd\n0.001749 0.728772 0.997515 Pd\n0.272978 0.271228 0.502484 Pd\n",
"nsites": 10,
"nelements": 3,
"elements": [
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],
"chemical_system": "In-Pd-Sr",
"density": 6.476744093981013,
"density_atomic": 0.03877910094485485,
"volume": 257.87085714597475,
"volume_molar": 15.529345996349118,
"formula_full": "Sr4 In2 Pd4",
"formula_reduced": "Sr2InPd2",
"formula_anonymous": "AB2C2",
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"spacegroup": 15
},
{
"id": "jvasp-105898",
"created_at": "2022-09-04T14:35:52.197695Z",
"updated_at": "2022-09-04T14:35:52.197716Z",
"structure_string": "Sr2 In1 Os1 O6\n1.0\n5.002092 0.000000 2.887959\n1.667364 4.716018 2.887959\n-0.000000 0.000000 5.775918\nSr In Os O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.749999 0.750000 0.750001 Sr\n0.499999 0.500000 0.500001 In\n0.000000 0.000000 0.000000 Os\n0.759065 0.240935 0.240935 O\n0.240934 0.759066 0.759066 O\n0.240934 0.759066 0.240935 O\n0.759065 0.240935 0.759066 O\n0.240934 0.240935 0.759066 O\n0.759064 0.759066 0.240935 O\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "In-O-Os-Sr",
"density": 7.023244903496956,
"density_atomic": 0.07339252878514067,
"volume": 136.25365095778847,
"volume_molar": 8.20538665131711,
"formula_full": "Sr2 In1 Os1 O6",
"formula_reduced": "Sr2InOsO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.042242859,
"spacegroup": 225
},
{
"id": "jvasp-5266",
"created_at": "2022-09-04T14:36:08.769338Z",
"updated_at": "2022-09-04T14:36:08.769358Z",
"structure_string": "Sr4 In2 I10\n1.0\n8.062741 -0.000000 -4.207665\n-2.195834 7.757970 -4.207665\n0.022533 0.029796 9.871935\nSr In I\n4 2 10\ndirect\n0.845332 0.345332 0.000001 Sr\n0.654669 0.845332 0.000001 Sr\n0.154669 0.654668 0.000001 Sr\n0.345332 0.154668 0.000000 Sr\n0.750000 0.750000 0.500001 In\n0.250000 0.250000 0.500001 In\n0.000000 0.000000 0.000000 I\n0.500000 0.500000 0.000001 I\n0.509986 0.009987 0.718374 I\n0.708387 0.509987 0.718374 I\n0.009986 0.208387 0.718374 I\n0.291613 0.490014 0.281627 I\n0.990014 0.791613 0.281628 I\n0.791613 0.291613 0.281628 I\n0.490014 0.990014 0.281628 I\n0.208387 0.708387 0.718374 I\n",
"nsites": 16,
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"density": 4.956454257023396,
"density_atomic": 0.02582660573879694,
"volume": 619.5161749793806,
"volume_molar": 23.31758505514137,
"formula_full": "Sr4 In2 I10",
"formula_reduced": "Sr2InI5",
"formula_anonymous": "AB2C5",
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"spacegroup": 140
},
{
"id": "jvasp-105865",
"created_at": "2022-09-04T14:36:03.426986Z",
"updated_at": "2022-09-04T14:36:03.427012Z",
"structure_string": "Sr2 In1 Hg1\n1.0\n4.910243 0.000000 2.834930\n1.636747 4.629421 2.834930\n-0.000000 -0.000000 5.669859\nSr In Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
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"elements": [
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],
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"density": 6.321457303543705,
"density_atomic": 0.031035451650410044,
"volume": 128.88486512317766,
"volume_molar": 19.404069990134765,
"formula_full": "Sr2 In1 Hg1",
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"spacegroup": 225
},
{
"id": "jvasp-80625",
"created_at": "2022-09-04T14:37:17.608589Z",
"updated_at": "2022-09-04T14:37:17.608623Z",
"structure_string": "Sr2 In1 Hg1\n1.0\n-11.491863 -0.000000 -6.634830\n-7.669220 0.325079 0.013819\n-6.540272 3.518228 -1.941578\nSr In Hg\n2 1 1\ndirect\n0.737632 -0.000000 0.000000 Sr\n0.262368 -0.000000 0.000000 Sr\n0.000000 0.000000 0.000000 In\n0.500000 -0.000000 0.000000 Hg\n",
"nsites": 4,
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"formula_full": "Sr2 In1 Hg1",
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"spacegroup": 71
},
{
"id": "jvasp-22007",
"created_at": "2022-09-04T14:37:38.083322Z",
"updated_at": "2022-09-04T14:37:38.083355Z",
"structure_string": "Sr8 In4 F28\n1.0\n0.000000 5.490570 0.002264\n12.380367 0.000000 0.000000\n0.000000 -0.089167 -8.358019\nSr In F\n8 4 28\ndirect\n0.763681 0.278498 0.554656 Sr\n0.236318 0.778498 0.945344 Sr\n0.236319 0.721503 0.445344 Sr\n0.763681 0.221503 0.054656 Sr\n0.236634 0.062342 0.324982 Sr\n0.763366 0.562343 0.175019 Sr\n0.763366 0.937658 0.675019 Sr\n0.236634 0.437658 0.824982 Sr\n0.279970 0.124546 0.788230 In\n0.720029 0.624546 0.711771 In\n0.279971 0.375454 0.288230 In\n0.720029 0.875454 0.211771 In\n0.988293 0.755265 0.692757 F\n0.495827 0.103945 0.573993 F\n0.011706 0.244735 0.307243 F\n0.988294 0.744735 0.192757 F\n0.011706 0.255265 0.807243 F\n0.201721 0.543181 0.286617 F\n0.986920 0.895920 0.411032 F\n0.986920 0.604080 0.911032 F\n0.013079 0.104080 0.588968 F\n0.798279 0.043181 0.213383 F\n0.504172 0.603945 0.926008 F\n0.013079 0.395920 0.088968 F\n0.504172 0.896056 0.426008 F\n0.364097 0.927546 0.124674 F\n0.495907 0.271289 0.798853 F\n0.504092 0.771289 0.701148 F\n0.504092 0.728712 0.201148 F\n0.495907 0.228712 0.298853 F\n0.201721 0.956819 0.786617 F\n0.635903 0.427546 0.375326 F\n0.635903 0.072455 0.875326 F\n0.364096 0.572455 0.624674 F\n0.791202 0.641803 0.463354 F\n0.208798 0.141802 0.036647 F\n0.208797 0.358198 0.536647 F\n0.791202 0.858198 0.963354 F\n0.495828 0.396055 0.073993 F\n0.798279 0.456819 0.713383 F\n",
"nsites": 40,
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"elements": [
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],
"chemical_system": "F-In-Sr",
"density": 4.945897717098439,
"density_atomic": 0.07040566355811134,
"volume": 568.1361126152138,
"volume_molar": 8.553489102520075,
"formula_full": "Sr8 In4 F28",
"formula_reduced": "Sr2InF7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-12433",
"created_at": "2022-09-04T14:37:10.033349Z",
"updated_at": "2022-09-04T14:37:10.033369Z",
"structure_string": "Sr4 In4 O10\n1.0\n5.563491 -0.000000 -1.906372\n-0.707185 5.712839 -2.063827\n-0.017135 -0.016045 9.021332\nSr In O\n4 4 10\ndirect\n0.123373 0.631518 0.214828 Sr\n0.908545 0.368483 0.785172 Sr\n0.623373 0.083311 0.214829 Sr\n0.408544 0.916690 0.785171 Sr\n0.291416 0.311811 0.500000 In\n0.501859 0.500000 -0.000000 In\n0.001860 0.000000 0.000000 In\n0.791415 0.688190 0.500000 In\n0.738388 0.725454 0.964336 O\n0.650605 0.367035 0.500000 O\n0.238388 0.738884 0.964336 O\n0.814104 0.943424 0.722445 O\n0.091660 0.056577 0.277555 O\n0.314105 0.279022 0.722445 O\n0.591659 0.720979 0.277555 O\n0.150605 0.632966 0.500000 O\n0.274052 0.261117 0.035664 O\n0.774051 0.274547 0.035664 O\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "In-O-Sr",
"density": 5.6238266570618265,
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"volume": 286.335482203569,
"volume_molar": 9.579736546735374,
"formula_full": "Sr4 In4 O10",
"formula_reduced": "Sr2In2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.0505977844444443,
"spacegroup": 46
}
]
}