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=-chemical_system&page=1106",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1104",
"results": [
{
"id": "jvasp-8590",
"created_at": "2022-09-04T14:37:04.231969Z",
"updated_at": "2022-09-04T14:37:04.232000Z",
"structure_string": "Rb1 I1\n1.0\n4.377275 0.000000 -0.000000\n-0.000000 4.377275 0.000000\n0.000000 0.000000 4.377275\nRb I\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"I"
],
"chemical_system": "I-Rb",
"density": 4.204703837405906,
"density_atomic": 0.023846162563239563,
"volume": 83.87093708247768,
"volume_molar": 25.254129439189217,
"formula_full": "Rb1 I1",
"formula_reduced": "RbI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0015,
"spacegroup": 221
},
{
"id": "jvasp-1945",
"created_at": "2022-09-04T14:36:45.063110Z",
"updated_at": "2022-09-04T14:36:45.063135Z",
"structure_string": "Rb1 I1\n1.0\n4.477162 0.000000 2.584892\n1.492387 4.221110 2.584892\n-0.000000 -0.000000 5.169782\nRb I\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.499999 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"I"
],
"chemical_system": "I-Rb",
"density": 3.6094846372329443,
"density_atomic": 0.020470492276591583,
"volume": 97.70160741503223,
"volume_molar": 29.418641616579194,
"formula_full": "Rb1 I1",
"formula_reduced": "RbI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-14588",
"created_at": "2022-09-04T14:35:56.380369Z",
"updated_at": "2022-09-04T14:35:56.380395Z",
"structure_string": "Ir1\n1.0\n2.378171 0.000000 1.373038\n0.792724 2.242160 1.373038\n0.000000 0.000000 2.746074\nIr\n1\ndirect\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 21.79811686329485,
"density_atomic": 0.06829329773071884,
"volume": 14.642725321934375,
"volume_molar": 8.818055299870512,
"formula_full": "Ir1",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"energy_above_hull": 1.0999999995320309e-06,
"spacegroup": 225
},
{
"id": "jvasp-78451",
"created_at": "2022-09-04T14:37:08.915582Z",
"updated_at": "2022-09-04T14:37:08.915602Z",
"structure_string": "Ir2\n1.0\n2.601856 0.000000 0.000000\n0.000000 2.665039 0.000000\n0.000000 -0.000000 4.615065\nIr\n2\ndirect\n0.000000 0.249981 0.250000 Ir\n0.000000 0.750019 0.749999 Ir\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 19.948316039991393,
"density_atomic": 0.0624978889272587,
"volume": 32.001080905753476,
"volume_molar": 9.635750684329786,
"formula_full": "Ir2",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"energy_above_hull": 0.5058210999999995,
"spacegroup": 191
},
{
"id": "jvasp-901",
"created_at": "2022-09-04T14:37:47.560661Z",
"updated_at": "2022-09-04T14:37:47.560691Z",
"structure_string": "Ir1\n1.0\n2.378164 0.000000 1.373034\n0.792722 2.242154 1.373034\n0.000000 0.000000 2.746067\nIr\n1\ndirect\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 21.79829492268868,
"density_atomic": 0.06829385558914637,
"volume": 14.64260571281797,
"volume_molar": 8.817983269576995,
"formula_full": "Ir1",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"energy_above_hull": 1.0999999995320309e-06,
"spacegroup": 225
},
{
"id": "jvasp-3957",
"created_at": "2022-09-04T14:36:35.865016Z",
"updated_at": "2022-09-04T14:36:35.865027Z",
"structure_string": "Rb2 Pt1 I6\n1.0\n6.868405 0.000000 3.965475\n2.289468 6.475594 3.965475\n0.000000 0.000000 7.930950\nRb Pt I\n2 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Pt\n0.758419 0.241581 0.241581 I\n0.241581 0.758419 0.758419 I\n0.758419 0.241581 0.758419 I\n0.241581 0.758419 0.241580 I\n0.758419 0.758419 0.241580 I\n0.241581 0.241581 0.758419 I\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"I"
],
"chemical_system": "I-Pt-Rb",
"density": 5.307430181312189,
"density_atomic": 0.025514190264670642,
"volume": 352.74488065812733,
"volume_molar": 23.603103596584937,
"formula_full": "Rb2 Pt1 I6",
"formula_reduced": "Rb2PtI6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-12891",
"created_at": "2022-09-04T14:38:34.810792Z",
"updated_at": "2022-09-04T14:38:34.810810Z",
"structure_string": "Pt4 I12\n1.0\n6.620346 0.000000 1.299752\n3.310173 6.060847 0.649876\n-0.056833 0.000000 13.461262\nPt I\n4 12\ndirect\n0.095058 0.809884 0.750000 Pt\n0.904942 0.190116 0.250000 Pt\n0.500000 0.500000 0.500000 Pt\n-0.000000 0.500000 0.000000 Pt\n0.802564 0.131050 0.637773 I\n0.066387 0.131050 0.862226 I\n0.197436 0.868951 0.362226 I\n0.933613 0.868951 0.137774 I\n0.855022 0.509654 0.378892 I\n0.635325 0.509654 0.121108 I\n0.144979 0.490346 0.621108 I\n0.364676 0.490346 0.878892 I\n0.259028 0.198108 0.122752 I\n0.542865 0.198108 0.377248 I\n0.740973 0.801893 0.877248 I\n0.457135 0.801893 0.622752 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Pt",
"I"
],
"chemical_system": "I-Pt",
"density": 7.074881644008843,
"density_atomic": 0.029597863689789894,
"volume": 540.5795555954052,
"volume_molar": 20.346538598586093,
"formula_full": "Pt4 I12",
"formula_reduced": "PtI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.37900255625,
"spacegroup": 15
},
{
"id": "jvasp-12896",
"created_at": "2022-09-04T14:38:30.605583Z",
"updated_at": "2022-09-04T14:38:30.605611Z",
"structure_string": "Pt4 I8\n1.0\n0.000000 6.711074 0.050032\n8.701878 0.000000 0.000000\n0.000000 -1.510726 -6.777316\nPt I\n4 8\ndirect\n0.239024 0.626957 0.496829 Pt\n0.760975 0.126957 0.003172 Pt\n0.760975 0.373043 0.503172 Pt\n0.239024 0.873043 -0.003171 Pt\n0.463861 0.833210 0.733405 I\n0.536138 0.333210 0.766596 I\n0.536138 0.166791 0.266595 I\n0.463861 0.666791 0.233405 I\n0.984193 0.914481 0.229377 I\n0.015806 0.414481 0.270623 I\n0.015806 0.085519 0.770623 I\n0.984193 0.585519 0.729378 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Pt",
"I"
],
"chemical_system": "I-Pt",
"density": 7.545906675882588,
"density_atomic": 0.030369721684435,
"volume": 395.1303908771151,
"volume_molar": 19.82942360346506,
"formula_full": "Pt4 I8",
"formula_reduced": "PtI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.54438465,
"spacegroup": 14
},
{
"id": "jvasp-5518",
"created_at": "2022-09-04T14:35:40.766734Z",
"updated_at": "2022-09-04T14:35:40.766748Z",
"structure_string": "P12 Se16 I4\n1.0\n0.000000 11.302487 0.048383\n6.515072 0.000000 0.000000\n0.000000 -6.566263 -12.703941\nP Se I\n12 16 4\ndirect\n0.828168 0.148520 0.868790 P\n0.709737 0.274739 0.548619 P\n0.290264 0.774739 0.951381 P\n0.709737 0.225261 0.048619 P\n0.670379 0.606872 0.508970 P\n0.329622 0.106873 0.991030 P\n0.290264 0.725261 0.451381 P\n0.670379 0.893127 0.008970 P\n0.828168 0.351480 0.368790 P\n0.171833 0.851480 0.131210 P\n0.171833 0.648519 0.631210 P\n0.329621 0.393127 0.491030 P\n0.463171 0.827645 0.609564 Se\n0.638503 0.174197 0.272631 Se\n0.361497 0.674196 0.227369 Se\n0.361498 0.825803 0.727369 Se\n0.638503 0.325803 0.772631 Se\n0.536829 0.172354 0.390436 Se\n0.463171 0.672354 0.109564 Se\n0.536830 0.327646 0.890436 Se\n0.897420 0.207989 0.532999 Se\n0.253608 0.165759 0.111399 Se\n0.253608 0.334241 0.611399 Se\n0.746393 0.834241 0.888602 Se\n0.102581 0.707989 0.967001 Se\n0.102581 0.792010 0.467001 Se\n0.897419 0.292010 0.032999 Se\n0.746392 0.665758 0.388602 Se\n0.142714 0.236403 0.815055 I\n0.857287 0.763597 0.184945 I\n0.142714 0.263597 0.315055 I\n0.857287 0.736402 0.684945 I\n",
"nsites": 32,
"nelements": 3,
"elements": [
"P",
"Se",
"I"
],
"chemical_system": "I-P-Se",
"density": 3.8118275414414233,
"density_atomic": 0.03428311294229959,
"volume": 933.404153055115,
"volume_molar": 17.565909986457772,
"formula_full": "P12 Se16 I4",
"formula_reduced": "P3Se4I",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.0594082802083333,
"spacegroup": 14
},
{
"id": "jvasp-88221",
"created_at": "2022-09-04T14:36:11.960896Z",
"updated_at": "2022-09-04T14:36:11.960907Z",
"structure_string": "P16 S12 I8\n1.0\n6.619154 0.000000 0.000000\n0.000000 9.334018 0.000000\n0.000000 0.000000 16.379173\nP S I\n16 12 8\ndirect\n0.454910 0.491162 0.353800 P\n0.045090 0.991162 0.146200 P\n0.199335 0.873219 0.250000 P\n0.699335 0.626781 0.750000 P\n0.741199 0.750645 0.250000 P\n0.454910 0.491162 0.146200 P\n0.241199 0.749356 0.750000 P\n0.758800 0.250645 0.250000 P\n0.954910 0.008838 0.853800 P\n0.545089 0.508839 0.646200 P\n0.258801 0.249355 0.750000 P\n0.954910 0.008838 0.646200 P\n0.300665 0.373219 0.250000 P\n0.800664 0.126781 0.750000 P\n0.045090 0.991162 0.353800 P\n0.545089 0.508839 0.853800 P\n0.250764 0.606573 0.646864 S\n0.249236 0.106572 0.646864 S\n0.456729 0.175098 0.250000 S\n0.956729 0.324902 0.750000 S\n0.749235 0.393428 0.353136 S\n0.043270 0.675098 0.250000 S\n0.749235 0.393428 0.146864 S\n0.250764 0.606573 0.853136 S\n0.543270 0.824902 0.750000 S\n0.249236 0.106572 0.853136 S\n0.750764 0.893428 0.146864 S\n0.750764 0.893428 0.353136 S\n0.230375 0.851732 0.462583 I\n0.730375 0.648269 0.962583 I\n0.269624 0.351732 0.037417 I\n0.269624 0.351732 0.462583 I\n0.769624 0.148269 0.962583 I\n0.769624 0.148269 0.537417 I\n0.230375 0.851732 0.037417 I\n0.730375 0.648269 0.537417 I\n",
"nsites": 36,
"nelements": 3,
"elements": [
"P",
"S",
"I"
],
"chemical_system": "I-P-S",
"density": 3.110511279578635,
"density_atomic": 0.035574549677867745,
"volume": 1011.9594014818111,
"volume_molar": 16.92822766424672,
"formula_full": "P16 S12 I8",
"formula_reduced": "P4S3I2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.2122282833333333,
"spacegroup": 62
},
{
"id": "jvasp-25004",
"created_at": "2022-09-04T14:37:44.789198Z",
"updated_at": "2022-09-04T14:37:44.789210Z",
"structure_string": "Pr6 Si4 S16 I2\n1.0\n7.874525 0.000000 0.000000\n-3.937263 7.928485 -1.129090\n0.000000 -0.021111 10.921361\nPr Si S I\n6 4 16 2\ndirect\n0.319248 0.395748 0.180949 Pr\n0.599588 0.000000 0.250000 Pr\n0.680752 0.604253 0.819051 Pr\n0.923500 0.604253 0.319051 Pr\n0.076500 0.395748 0.680949 Pr\n0.400412 0.000000 0.750000 Pr\n0.303060 0.680717 0.971708 Si\n0.622343 0.319283 0.528291 Si\n0.377658 0.680717 0.471708 Si\n0.696940 0.319283 0.028292 Si\n0.549141 0.298519 0.337526 S\n0.851215 0.564366 0.585216 S\n0.722494 0.135380 0.541030 S\n0.891063 0.290033 0.146301 S\n0.749378 0.298520 0.837526 S\n0.277506 0.864621 0.458970 S\n0.601030 0.709967 0.353699 S\n0.450859 0.701481 0.662474 S\n0.250623 0.701481 0.162474 S\n0.412885 0.135379 0.041030 S\n0.108937 0.709967 0.853699 S\n0.398970 0.290034 0.646301 S\n0.148786 0.435635 0.414784 S\n0.587115 0.864621 0.958970 S\n0.713151 0.564366 0.085216 S\n0.286849 0.435635 0.914784 S\n0.983728 0.000000 0.750000 I\n0.016272 0.000000 0.250000 I\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Pr",
"Si",
"S",
"I"
],
"chemical_system": "I-Pr-S-Si",
"density": 4.201215764360557,
"density_atomic": 0.041075821837129406,
"volume": 681.6662150065647,
"volume_molar": 14.661035350378418,
"formula_full": "Pr6 Si4 S16 I2",
"formula_reduced": "Pr3Si2S8I",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.198293073214286,
"spacegroup": 15
},
{
"id": "jvasp-97375",
"created_at": "2022-09-04T14:36:06.519849Z",
"updated_at": "2022-09-04T14:36:06.519871Z",
"structure_string": "Pr6 Ru2 I6\n1.0\n4.287496 0.000000 0.000000\n0.000000 9.265606 -0.546535\n0.000000 0.025352 12.518608\nPr Ru I\n6 2 6\ndirect\n0.750001 0.311568 0.119560 Pr\n0.250000 0.688432 0.880440 Pr\n0.250000 0.116532 0.336061 Pr\n0.750001 0.883468 0.663939 Pr\n0.250000 0.099055 0.889044 Pr\n0.750001 0.900946 0.110956 Pr\n0.250000 0.109882 0.120788 Ru\n0.750001 0.890118 0.879213 Ru\n0.250000 0.142437 0.616830 I\n0.750001 0.857563 0.383170 I\n0.750001 0.375821 0.379817 I\n0.250000 0.624179 0.620183 I\n0.250000 0.605487 0.137227 I\n0.750001 0.394513 0.862773 I\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Pr",
"Ru",
"I"
],
"chemical_system": "I-Pr-Ru",
"density": 6.03955924562782,
"density_atomic": 0.028147677306182176,
"volume": 497.3767408128247,
"volume_molar": 21.394805313749053,
"formula_full": "Pr6 Ru2 I6",
"formula_reduced": "Pr3RuI3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.2507912678571431,
"spacegroup": 11
}
]
}