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_reduced&page=1036",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=1034",
"results": [
{
"id": "jvasp-103872",
"created_at": "2022-09-04T14:36:47.764684Z",
"updated_at": "2022-09-04T14:36:47.764695Z",
"structure_string": "Sn1 H10 C6 O4\n1.0\n4.766386 -0.063273 -0.064045\n-0.854146 6.050266 -0.502140\n0.060752 -0.270936 6.862455\nSn H C O\n1 10 6 4\ndirect\n0.859829 0.845708 0.343503 Sn\n0.909358 0.628495 0.658080 H\n0.093860 0.511454 0.452176 H\n0.250758 0.146794 0.211088 H\n0.909678 0.228327 0.175867 H\n0.715810 0.443011 0.461104 H\n0.760829 0.251087 0.753496 H\n0.529562 0.109611 0.910689 H\n0.197720 0.396621 0.911375 H\n0.412891 0.534007 0.744345 H\n0.019941 0.007138 0.011439 H\n0.030046 0.089369 0.162554 C\n0.898379 0.572808 0.500326 C\n0.369624 0.078471 0.621855 C\n0.593742 0.571370 0.029459 C\n0.537925 0.217240 0.792346 C\n0.416995 0.429913 0.864298 C\n0.854796 0.560296 0.050979 O\n0.103698 0.078999 0.611796 O\n0.489627 0.956774 0.491277 O\n0.476565 0.708162 0.150139 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 2.2337115969400307,
"density_atomic": 0.1066584704286722,
"volume": 196.89012898458674,
"volume_molar": 5.646190814284464,
"formula_full": "Sn1 H10 C6 O4",
"formula_reduced": "SnH10(C3O2)2",
"formula_anonymous": "AB4C6D10",
"energy_above_hull": 4.322264557142857,
"spacegroup": 1
},
{
"id": "jvasp-115043",
"created_at": "2022-09-04T14:38:43.774108Z",
"updated_at": "2022-09-04T14:38:43.774118Z",
"structure_string": "Sn1 Ge1 S4\n1.0\n-2.626858 2.626858 5.082918\n2.626858 -2.626858 5.082918\n2.626858 2.626858 -5.082918\nSn Ge S\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Sn\n0.750000 0.250000 0.500000 Ge\n0.527078 0.027078 0.500000 S\n0.238321 0.238321 0.000000 S\n0.972923 0.472922 0.500000 S\n0.761678 0.761678 0.000000 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sn",
"Ge",
"S"
],
"chemical_system": "Ge-S-Sn",
"density": 3.7828852550468453,
"density_atomic": 0.0427666233710333,
"volume": 140.29632285779013,
"volume_molar": 14.081403406000295,
"formula_full": "Sn1 Ge1 S4",
"formula_reduced": "SnGeS4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6093829416666667,
"spacegroup": 119
},
{
"id": "jvasp-14160",
"created_at": "2022-09-04T14:36:58.177233Z",
"updated_at": "2022-09-04T14:36:58.177259Z",
"structure_string": "Sn4 Ge4 S12\n1.0\n0.000000 6.930911 -0.084400\n10.205039 0.000000 0.000000\n0.000000 -2.004348 -7.034067\nSn Ge S\n4 4 12\ndirect\n0.727752 0.417131 0.873392 Sn\n0.772248 0.917131 0.126609 Sn\n0.272248 0.582869 0.126609 Sn\n0.227752 0.082869 0.873392 Sn\n0.001809 0.707413 0.679001 Ge\n0.501808 0.792587 0.679001 Ge\n0.998191 0.292587 0.320999 Ge\n0.498191 0.207413 0.320999 Ge\n0.421731 0.322671 0.053714 S\n0.078269 0.822671 0.946287 S\n0.587109 0.996899 0.775086 S\n0.912891 0.496899 0.224914 S\n0.412891 0.003101 0.224914 S\n0.183679 0.787606 0.485602 S\n0.816321 0.212394 0.514399 S\n0.316321 0.287606 0.514399 S\n0.578269 0.677329 0.946287 S\n0.921731 0.177329 0.053714 S\n0.087109 0.503101 0.775086 S\n0.683679 0.712394 0.485602 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sn",
"Ge",
"S"
],
"chemical_system": "Ge-S-Sn",
"density": 3.825595618027194,
"density_atomic": 0.040060295450382546,
"volume": 499.24744126691195,
"volume_molar": 15.032691826895883,
"formula_full": "Sn4 Ge4 S12",
"formula_reduced": "SnGeS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.38085353,
"spacegroup": 14
},
{
"id": "jvasp-10316",
"created_at": "2022-09-04T14:37:18.912174Z",
"updated_at": "2022-09-04T14:37:18.912189Z",
"structure_string": "Sn2 Ge4 O12\n1.0\n5.468944 0.036628 1.266072\n1.498783 6.588415 0.684033\n0.129992 -0.078997 6.789575\nSn Ge O\n2 4 12\ndirect\n0.749999 0.896564 0.103435 Sn\n0.250000 0.103435 0.896565 Sn\n0.735660 0.392239 0.216529 Ge\n0.764338 0.783470 0.607761 Ge\n0.264338 0.607760 0.783471 Ge\n0.235661 0.216529 0.392239 Ge\n0.638766 0.957448 0.815926 O\n0.861232 0.184075 0.042551 O\n0.679194 0.623717 0.080142 O\n0.820804 0.919857 0.376283 O\n0.320804 0.376283 0.919858 O\n0.528092 0.655325 0.601356 O\n-0.028093 0.398644 0.344675 O\n0.138766 0.815924 0.957449 O\n0.028093 0.601355 0.655326 O\n0.471906 0.344674 0.398644 O\n0.179195 0.080142 0.623718 O\n0.361233 0.042551 0.184075 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sn",
"Ge",
"O"
],
"chemical_system": "Ge-O-Sn",
"density": 4.9132257488200946,
"density_atomic": 0.07397313717892796,
"volume": 243.331575304981,
"volume_molar": 8.14098332132853,
"formula_full": "Sn2 Ge4 O12",
"formula_reduced": "Sn(GeO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.980736066666667,
"spacegroup": 15
},
{
"id": "jvasp-99606",
"created_at": "2022-09-04T14:37:00.231100Z",
"updated_at": "2022-09-04T14:37:00.231123Z",
"structure_string": "Sn1 Ge1 O3\n1.0\n3.859727 -0.000000 0.000000\n0.000000 3.859727 0.000000\n-0.000000 0.000000 3.859727\nSn Ge O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Ge\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sn",
"Ge",
"O"
],
"chemical_system": "Ge-O-Sn",
"density": 6.912091831698317,
"density_atomic": 0.08695613748279371,
"volume": 57.50025409062547,
"volume_molar": 6.925492477390247,
"formula_full": "Sn1 Ge1 O3",
"formula_reduced": "SnGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.52110763,
"spacegroup": 221
},
{
"id": "jvasp-99629",
"created_at": "2022-09-04T14:36:33.873254Z",
"updated_at": "2022-09-04T14:36:33.873277Z",
"structure_string": "Sn2 Ge2 O6\n1.0\n4.943769 0.012652 5.091806\n2.073477 4.487951 5.091806\n0.019727 0.012652 7.096968\nSn Ge O\n2 2 6\ndirect\n0.166664 0.166664 0.166664 Sn\n0.833338 0.833335 0.833337 Sn\n0.392006 0.392004 0.392005 Ge\n0.607996 0.607994 0.607996 Ge\n0.106369 0.440883 0.776606 O\n0.440885 0.776605 0.106369 O\n0.223395 0.893631 0.559116 O\n0.776606 0.106368 0.440885 O\n0.559117 0.223394 0.893632 O\n0.893632 0.559115 0.223395 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sn",
"Ge",
"O"
],
"chemical_system": "Ge-O-Sn",
"density": 5.074571356832399,
"density_atomic": 0.0638395923137707,
"volume": 156.64260433948482,
"volume_molar": 9.433238123453643,
"formula_full": "Sn2 Ge2 O6",
"formula_reduced": "SnGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.49862563,
"spacegroup": 148
},
{
"id": "jvasp-2196",
"created_at": "2022-09-04T14:36:18.077000Z",
"updated_at": "2022-09-04T14:36:18.077021Z",
"structure_string": "Sn1 F4\n1.0\n3.758151 -0.000000 -1.707986\n-0.776245 3.677088 -1.708004\n-0.046486 -0.057353 4.886312\nSn F\n1 4\ndirect\n0.000000 0.000000 0.000000 Sn\n0.755610 0.755591 0.511222 F\n-0.000001 0.500000 0.000000 F\n0.500000 -0.000000 -0.000000 F\n0.244388 0.244411 0.488778 F\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.840879343221086,
"density_atomic": 0.07486367714982689,
"volume": 66.78806318841849,
"volume_molar": 8.044142352168612,
"formula_full": "Sn1 F4",
"formula_reduced": "SnF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-30605",
"created_at": "2022-09-04T14:37:31.854902Z",
"updated_at": "2022-09-04T14:37:31.854910Z",
"structure_string": "Sn2 F8\n1.0\n5.074359 -0.000407 -2.344168\n-1.435850 3.919504 -3.108683\n0.348793 -0.687022 7.416699\nSn F\n2 8\ndirect\n0.942832 0.499264 -0.001274 Sn\n0.554089 -0.000734 -0.001259 Sn\n0.955656 0.384841 0.219008 F\n0.541249 0.113710 0.778471 F\n0.214740 0.574022 0.738296 F\n0.021812 0.074000 0.738276 F\n0.282200 0.924494 0.259219 F\n0.475116 0.424477 0.259249 F\n0.761505 0.884908 0.219053 F\n0.735444 0.613652 0.778428 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.7006346020152625,
"density_atomic": 0.07269480734680311,
"volume": 137.56140727209407,
"volume_molar": 8.284141577362382,
"formula_full": "Sn2 F8",
"formula_reduced": "SnF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.011606,
"spacegroup": 15
},
{
"id": "jvasp-12193",
"created_at": "2022-09-04T14:37:10.448202Z",
"updated_at": "2022-09-04T14:37:10.448226Z",
"structure_string": "Sn2 F8\n1.0\n5.074319 -0.002322 -2.346086\n-1.437427 3.915101 -3.113842\n0.346627 -0.676801 7.419598\nSn F\n2 8\ndirect\n0.942796 0.499249 -0.001264 Sn\n0.554118 -0.000734 -0.001274 Sn\n0.955813 0.384844 0.219027 F\n0.541107 0.113631 0.778419 F\n0.214576 0.574106 0.738269 F\n0.021643 0.074130 0.738302 F\n0.282321 0.924472 0.259278 F\n0.475374 0.424451 0.259258 F\n0.761577 0.884759 0.218968 F\n0.735325 0.613734 0.778487 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.699776497065509,
"density_atomic": 0.07268153684626709,
"volume": 137.58652381211445,
"volume_molar": 8.285654130756448,
"formula_full": "Sn2 F8",
"formula_reduced": "SnF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0116299999999999,
"spacegroup": 15
},
{
"id": "jvasp-11274",
"created_at": "2022-09-04T14:38:28.883880Z",
"updated_at": "2022-09-04T14:38:28.883909Z",
"structure_string": "Sn2 F8\n1.0\n-5.590358 0.007138 -0.020428\n-0.008967 -5.088183 1.093532\n2.786751 1.146589 4.600173\nSn F\n2 8\ndirect\n0.057161 0.500462 0.001226 Sn\n0.445912 0.000563 0.001281 Sn\n0.044088 0.165883 0.780921 F\n0.458986 0.335152 0.221574 F\n0.785517 0.835701 0.261734 F\n0.978466 0.335675 0.261644 F\n0.717557 0.665334 0.740782 F\n0.524598 0.165362 0.740861 F\n0.238316 0.665837 0.781061 F\n0.264754 0.835193 0.221444 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.699561974796909,
"density_atomic": 0.07267821928251075,
"volume": 137.5928042640747,
"volume_molar": 8.286032348413858,
"formula_full": "Sn2 F8",
"formula_reduced": "SnF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0116299999999999,
"spacegroup": 15
},
{
"id": "jvasp-30616",
"created_at": "2022-09-04T14:37:11.892503Z",
"updated_at": "2022-09-04T14:37:11.892518Z",
"structure_string": "Sn4 F12\n1.0\n4.064317 -0.440817 0.082509\n-1.355826 7.690024 -1.645640\n1.643971 -0.750886 8.298540\nSn F\n4 12\ndirect\n0.253503 0.754076 0.244770 Sn\n0.746496 0.245923 0.755229 Sn\n0.063996 0.751718 0.749870 Sn\n-0.063997 0.248281 0.250130 Sn\n0.884025 0.321554 0.544073 F\n0.115974 0.678445 0.455927 F\n0.385846 0.817524 0.030131 F\n0.614153 0.182475 -0.030131 F\n0.757284 0.759427 0.242984 F\n0.242716 0.240572 0.757016 F\n0.662440 -0.013915 0.634395 F\n0.337560 0.013914 0.365605 F\n0.514900 0.377109 0.315772 F\n0.485099 0.622890 0.684228 F\n0.832446 0.510124 0.872895 F\n0.167554 0.489874 0.127104 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.675356132658349,
"density_atomic": 0.06409747965430344,
"volume": 249.6197991916797,
"volume_molar": 9.395284795095185,
"formula_full": "Sn4 F12",
"formula_reduced": "SnF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.002255,
"spacegroup": 2
},
{
"id": "jvasp-2769",
"created_at": "2022-09-04T14:36:41.956184Z",
"updated_at": "2022-09-04T14:36:41.956192Z",
"structure_string": "Sn2 F6\n1.0\n5.362497 -0.000000 3.096039\n1.787499 5.055810 3.096039\n-0.000000 -0.000000 6.192078\nSn F\n2 6\ndirect\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.270924 0.729077 0.729077 F\n0.270924 0.729077 0.270923 F\n0.729077 0.270923 0.270923 F\n0.729077 0.729077 0.270923 F\n0.270923 0.270923 0.729077 F\n0.729077 0.270923 0.729077 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 3.475917870298018,
"density_atomic": 0.04765360512649911,
"volume": 167.87816952701817,
"volume_molar": 12.637324592785577,
"formula_full": "Sn2 F6",
"formula_reduced": "SnF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}