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=4181",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4179",
"results": [
{
"id": "jvasp-115407",
"created_at": "2022-09-04T14:38:46.203137Z",
"updated_at": "2022-09-04T14:38:46.203160Z",
"structure_string": "As1 N1 F1\n1.0\n4.107091 0.000000 0.000000\n0.000000 4.107091 0.000000\n0.000000 0.000000 7.872600\nAs N F\n1 1 1\ndirect\n0.000000 0.000000 -0.002534 As\n0.000000 0.000000 0.786071 N\n0.000000 0.000000 0.237588 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"N",
"F"
],
"chemical_system": "As-F-N",
"density": 1.3495568115537264,
"density_atomic": 0.022590946016041922,
"volume": 132.79656362640537,
"volume_molar": 26.657319953416977,
"formula_full": "As1 N1 F1",
"formula_reduced": "AsNF",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4129650941666663,
"spacegroup": 99
},
{
"id": "jvasp-115406",
"created_at": "2022-09-04T14:38:44.415559Z",
"updated_at": "2022-09-04T14:38:44.415586Z",
"structure_string": "As1 N1 F2\n1.0\n3.225501 -0.000000 -0.000000\n0.000000 3.225501 0.000000\n0.000000 0.000000 5.050063\nAs N F\n1 1 2\ndirect\n0.500000 0.500000 0.741019 As\n0.000000 0.000000 0.739214 N\n0.000000 0.000000 0.439121 F\n0.500000 0.500000 0.090645 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"As",
"N",
"F"
],
"chemical_system": "As-F-N",
"density": 4.011487800981264,
"density_atomic": 0.07613227954049741,
"volume": 52.54013178302721,
"volume_molar": 7.91010172865849,
"formula_full": "As1 N1 F2",
"formula_reduced": "AsNF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.66428139125,
"spacegroup": 99
},
{
"id": "jvasp-91637",
"created_at": "2022-09-04T14:35:51.644173Z",
"updated_at": "2022-09-04T14:35:51.644189Z",
"structure_string": "As1 N1 F6\n1.0\n3.867658 2.232993 1.942571\n-3.867658 2.232992 1.942571\n0.000000 -4.465987 1.942571\nAs N F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 As\n0.499999 0.499999 0.500000 N\n0.656461 0.779197 0.018572 F\n0.779197 0.018571 0.656462 F\n0.018571 0.656461 0.779198 F\n0.343539 0.220802 -0.018571 F\n0.220802 -0.018572 0.343539 F\n-0.018572 0.343539 0.220802 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"As",
"N",
"F"
],
"chemical_system": "As-F-N",
"density": 3.3473999098062297,
"density_atomic": 0.07947423884126614,
"volume": 100.66154915907275,
"volume_molar": 7.577475226944946,
"formula_full": "As1 N1 F6",
"formula_reduced": "AsNF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.837517086875,
"spacegroup": 148
},
{
"id": "jvasp-117072",
"created_at": "2022-09-04T14:38:45.239564Z",
"updated_at": "2022-09-04T14:38:45.239593Z",
"structure_string": "Mn2 As4 F24\n1.0\n6.839208 0.052454 -6.293592\n-1.281763 6.718229 -6.293592\n-0.043055 -0.052454 9.294203\nMn As F\n2 4 24\ndirect\n0.750000 0.250000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.779354 0.779353 0.000000 As\n0.220647 0.220647 0.000000 As\n0.970647 0.470646 0.500000 As\n0.529353 0.029353 0.500000 As\n0.020996 0.914260 0.202251 F\n0.299883 0.107475 0.341694 F\n0.892525 0.234219 0.192408 F\n0.041811 0.700118 0.807592 F\n0.765781 0.958189 0.658306 F\n0.984219 0.142525 0.692408 F\n0.712008 0.818745 0.797750 F\n0.708189 0.015780 0.158306 F\n0.857475 0.549883 0.841694 F\n0.450117 0.291811 0.307592 F\n0.568746 0.962008 0.297750 F\n0.037992 0.335741 0.606736 F\n0.085740 0.287992 0.106736 F\n0.504227 0.117128 0.714833 F\n0.729004 0.431255 0.393264 F\n0.664260 0.270996 0.702251 F\n0.210606 0.495773 0.612901 F\n0.245773 0.460607 0.112901 F\n0.347704 0.132872 0.887099 F\n0.402296 0.789394 0.285168 F\n0.539393 0.652296 0.785167 F\n0.867129 0.754227 0.214833 F\n0.181255 0.979005 0.893264 F\n0.882872 0.597704 0.387099 F\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Mn",
"As",
"F"
],
"chemical_system": "As-F-Mn",
"density": 3.3962624595308557,
"density_atomic": 0.0708915061443666,
"volume": 423.18186806338514,
"volume_molar": 8.494869255191512,
"formula_full": "Mn2 As4 F24",
"formula_reduced": "MnAs2F12",
"formula_anonymous": "AB2C12",
"energy_above_hull": 0.4434522754252872,
"spacegroup": 122
},
{
"id": "jvasp-104823",
"created_at": "2022-09-04T14:36:57.332226Z",
"updated_at": "2022-09-04T14:36:57.332253Z",
"structure_string": "Rb2 Li1 As1 F6\n1.0\n5.133938 -0.000000 2.964081\n1.711313 4.840323 2.964081\n-0.000000 -0.000000 5.928161\nRb Li As F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.749999 0.750000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 As\n0.248529 0.248529 0.751470 F\n0.248529 0.751470 0.751471 F\n0.751471 0.751470 0.248529 F\n0.248529 0.751470 0.248530 F\n0.751471 0.248529 0.751470 F\n0.751471 0.248529 0.248529 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"As",
"F"
],
"chemical_system": "As-F-Li-Rb",
"density": 4.134471439366808,
"density_atomic": 0.06788206525866784,
"volume": 147.31431581956917,
"volume_molar": 8.871475458285403,
"formula_full": "Rb2 Li1 As1 F6",
"formula_reduced": "Rb2LiAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99590",
"created_at": "2022-09-04T14:36:34.832128Z",
"updated_at": "2022-09-04T14:36:34.832159Z",
"structure_string": "Na2 Li1 As1 F6\n1.0\n4.909423 -0.000000 2.834456\n1.636474 4.628648 2.834456\n-0.000000 -0.000000 5.668913\nNa Li As F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.499999 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 As\n0.744930 0.255069 0.255070 F\n0.255069 0.255069 0.744931 F\n0.255068 0.744931 0.744932 F\n0.255068 0.744931 0.255070 F\n0.744930 0.255069 0.744932 F\n0.744930 0.744931 0.255070 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Li",
"As",
"F"
],
"chemical_system": "As-F-Li-Na",
"density": 3.1173062270392977,
"density_atomic": 0.07762750008364577,
"volume": 128.82032770892692,
"volume_molar": 7.757741462124863,
"formula_full": "Na2 Li1 As1 F6",
"formula_reduced": "Na2LiAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-22386",
"created_at": "2022-09-04T14:38:00.933994Z",
"updated_at": "2022-09-04T14:38:00.934027Z",
"structure_string": "Li1 As1 F6\n1.0\n4.382018 0.049231 2.882912\n1.579467 4.087762 2.882912\n0.070943 0.049232 5.244829\nLi As F\n1 1 6\ndirect\n0.500000 0.499999 0.500000 Li\n0.000000 0.000000 0.000000 As\n0.356977 0.770628 0.104679 F\n0.104680 0.356976 0.770629 F\n0.770629 0.104679 0.356976 F\n0.895321 0.643023 0.229371 F\n0.229372 0.895319 0.643023 F\n0.643023 0.229371 0.895320 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"As",
"F"
],
"chemical_system": "As-F-Li",
"density": 3.5228711507830446,
"density_atomic": 0.08665774382584635,
"volume": 92.31719690368789,
"volume_molar": 6.949339429033058,
"formula_full": "Li1 As1 F6",
"formula_reduced": "LiAsF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0047679306249999,
"spacegroup": 148
},
{
"id": "jvasp-100075",
"created_at": "2022-09-04T14:36:44.947814Z",
"updated_at": "2022-09-04T14:36:44.947844Z",
"structure_string": "Li3 As1 F6\n1.0\n4.874539 -0.000000 2.814317\n1.624846 4.595759 2.814317\n-0.000000 -0.000000 5.628632\nLi As F\n3 1 6\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 As\n0.255972 0.255972 0.744028 F\n0.255973 0.744028 0.744028 F\n0.744028 0.744028 0.255973 F\n0.255973 0.744028 0.255972 F\n0.744028 0.255972 0.744028 F\n0.744028 0.255972 0.255973 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"As",
"F"
],
"chemical_system": "As-F-Li",
"density": 2.762017312298878,
"density_atomic": 0.07930605535219472,
"volume": 126.09377626450386,
"volume_molar": 7.593544696247892,
"formula_full": "Li3 As1 F6",
"formula_reduced": "Li3AsF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.1752953445000002,
"spacegroup": 225
},
{
"id": "jvasp-102062",
"created_at": "2022-09-04T14:37:02.994891Z",
"updated_at": "2022-09-04T14:37:02.994918Z",
"structure_string": "K2 Tl1 As1 F6\n1.0\n5.686296 -0.000000 3.282985\n1.895432 5.361091 3.282985\n-0.000000 -0.000000 6.565969\nK Tl As F\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 As\n0.778130 0.221871 0.221870 F\n0.221871 0.221871 0.778129 F\n0.221871 0.778129 0.778129 F\n0.221871 0.778129 0.221870 F\n0.778130 0.221871 0.778129 F\n0.778130 0.778129 0.221869 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"F"
],
"chemical_system": "As-F-K-Tl",
"density": 3.911486909697325,
"density_atomic": 0.04995955137301745,
"volume": 200.16192550121417,
"volume_molar": 12.054032901609453,
"formula_full": "K2 Tl1 As1 F6",
"formula_reduced": "K2TlAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100590",
"created_at": "2022-09-04T14:37:09.798306Z",
"updated_at": "2022-09-04T14:37:09.798337Z",
"structure_string": "K1 Rb2 As1 F6\n1.0\n5.585814 -0.000000 3.224971\n1.861938 5.266356 3.224971\n-0.000000 0.000000 6.449942\nK Rb As F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750001 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 As\n0.773401 0.226599 0.226599 F\n0.226599 0.226599 0.773401 F\n0.226599 0.773402 0.773401 F\n0.226599 0.773402 0.226598 F\n0.773401 0.226599 0.773401 F\n0.773401 0.773402 0.226598 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"As",
"F"
],
"chemical_system": "As-F-K-Rb",
"density": 3.4914886242704,
"density_atomic": 0.0527044768542185,
"volume": 189.73720254657255,
"volume_molar": 11.426241411440904,
"formula_full": "K1 Rb2 As1 F6",
"formula_reduced": "KRb2AsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-95318",
"created_at": "2022-09-04T14:36:32.756625Z",
"updated_at": "2022-09-04T14:36:32.756644Z",
"structure_string": "K4 As4 O4 F16\n1.0\n5.043691 0.000000 -0.152915\n0.000000 5.744298 0.000000\n0.100669 0.000000 13.611186\nK As O F\n4 4 4 16\ndirect\n-0.008861 0.868515 0.652381 K\n0.508861 0.368514 0.847619 K\n0.008861 0.131486 0.347619 K\n0.491139 0.631486 0.152381 K\n0.570899 0.377666 0.581548 As\n0.429101 0.622334 0.418452 As\n0.070899 0.122334 0.081548 As\n0.929101 0.877666 0.918452 As\n0.709081 0.608924 0.505294 O\n0.790920 0.108924 0.994706 O\n0.290919 0.391076 0.494706 O\n0.209081 0.891076 0.005294 O\n0.573362 0.412812 0.334727 F\n0.737949 0.147936 0.517685 F\n0.762051 0.647936 0.982315 F\n0.262051 0.852064 0.482315 F\n0.425530 0.155815 0.655684 F\n0.926638 0.912812 0.165273 F\n0.074470 0.655815 0.844316 F\n0.925530 0.344185 0.155684 F\n0.852658 0.383082 0.665045 F\n0.647342 0.883082 0.834955 F\n0.237949 0.352064 0.017685 F\n0.352658 0.116918 0.165045 F\n0.426638 0.587188 0.665273 F\n0.073362 0.087188 0.834727 F\n0.574470 0.844185 0.344316 F\n0.147342 0.616918 0.334955 F\n",
"nsites": 28,
"nelements": 4,
"elements": [
"K",
"As",
"O",
"F"
],
"chemical_system": "As-F-K-O",
"density": 3.469163402660807,
"density_atomic": 0.07098707084655416,
"volume": 394.4380246443028,
"volume_molar": 8.483433233944073,
"formula_full": "K4 As4 O4 F16",
"formula_reduced": "KAsOF4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 0.1929549114285718,
"spacegroup": 14
},
{
"id": "jvasp-109484",
"created_at": "2022-09-04T14:38:19.028322Z",
"updated_at": "2022-09-04T14:38:19.028344Z",
"structure_string": "K1 Na2 As1 F6\n1.0\n5.496889 -0.000000 3.173630\n1.832296 5.182516 3.173630\n-0.000000 -0.000000 6.347260\nK Na As F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750001 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 As\n0.771743 0.228257 0.228257 F\n0.228257 0.228257 0.771743 F\n0.228257 0.771744 0.771742 F\n0.228257 0.771744 0.228256 F\n0.771743 0.228257 0.771743 F\n0.771744 0.771744 0.228256 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"As",
"F"
],
"chemical_system": "As-F-K-Na",
"density": 2.516168244907893,
"density_atomic": 0.05530394254661386,
"volume": 180.81893513416935,
"volume_molar": 10.889170794512774,
"formula_full": "K1 Na2 As1 F6",
"formula_reduced": "KNa2AsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}