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=37",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=35",
"results": [
{
"id": "jvasp-13293",
"created_at": "2022-09-04T14:36:38.753459Z",
"updated_at": "2022-09-04T14:36:38.753486Z",
"structure_string": "Ag3 As2 O8\n1.0\n5.873759 0.134291 0.134291\n0.134291 5.873759 0.134291\n0.134291 0.134291 5.873759\nAg As O\n3 2 8\ndirect\n0.488068 0.745402 0.003810 Ag\n0.745402 0.003810 0.488068 Ag\n0.003810 0.488068 0.745402 Ag\n0.997984 0.997984 0.997984 As\n0.501445 0.501445 0.501445 As\n0.159932 0.785037 0.851881 O\n0.154087 0.154087 0.154087 O\n0.345645 0.342249 0.698203 O\n0.342249 0.698203 0.345645 O\n0.698203 0.345645 0.342249 O\n0.676257 0.676257 0.676257 O\n0.851881 0.159932 0.785037 O\n0.785037 0.851881 0.159932 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ag",
"As",
"O"
],
"chemical_system": "Ag-As-O",
"density": 4.935900213480184,
"density_atomic": 0.06424896729218416,
"volume": 202.33788258230013,
"volume_molar": 9.373132384545876,
"formula_full": "Ag3 As2 O8",
"formula_reduced": "Ag3(AsO4)2",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.134008713846154,
"spacegroup": 146
},
{
"id": "jvasp-103223",
"created_at": "2022-09-04T14:36:37.580438Z",
"updated_at": "2022-09-04T14:36:37.580463Z",
"structure_string": "Ag3 Au1\n1.0\n4.128048 -0.000000 -0.000000\n0.000000 4.128048 -0.000000\n0.000000 0.000000 4.128048\nAg Au\n3 1\ndirect\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Au"
],
"chemical_system": "Ag-Au",
"density": 12.288390209216637,
"density_atomic": 0.0568624772066715,
"volume": 70.34515899582884,
"volume_molar": 10.59071123143654,
"formula_full": "Ag3 Au1",
"formula_reduced": "Ag3Au",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0023049999999999,
"spacegroup": 221
},
{
"id": "jvasp-106488",
"created_at": "2022-09-04T14:36:59.543991Z",
"updated_at": "2022-09-04T14:36:59.544014Z",
"structure_string": "Ag3 Au1\n1.0\n3.781628 0.012716 -3.364947\n-0.753276 3.705867 -3.364947\n-0.010356 -0.012716 5.061964\nAg Au\n3 1\ndirect\n0.750000 0.250000 0.499999 Ag\n0.249999 0.750000 0.499999 Ag\n0.500000 0.500001 0.000000 Ag\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Au"
],
"chemical_system": "Ag-Au",
"density": 12.23274049612296,
"density_atomic": 0.05660496743619125,
"volume": 70.6651762410968,
"volume_molar": 10.638890953852314,
"formula_full": "Ag3 Au1",
"formula_reduced": "Ag3Au",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-8804",
"created_at": "2022-09-04T14:36:34.028594Z",
"updated_at": "2022-09-04T14:36:34.028613Z",
"structure_string": "Ag3 Au1 S2\n1.0\n5.371375 -0.220380 -0.220380\n-0.220380 5.371375 -0.220380\n-0.220380 -0.220380 5.371375\nAg Au S\n3 1 2\ndirect\n0.166680 0.666693 0.166680 Ag\n0.166680 0.166680 0.666693 Ag\n0.666693 0.166680 0.166680 Ag\n0.666647 0.666647 0.666647 Au\n0.935183 0.935183 0.935183 S\n0.398118 0.398118 0.398118 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"Au",
"S"
],
"chemical_system": "Ag-Au-S",
"density": 6.2977540735397515,
"density_atomic": 0.03891830240123174,
"volume": 154.16910887177093,
"volume_molar": 15.473801241159489,
"formula_full": "Ag3 Au1 S2",
"formula_reduced": "Ag3AuS2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6234315583333334,
"spacegroup": 166
},
{
"id": "jvasp-8816",
"created_at": "2022-09-04T14:36:42.559582Z",
"updated_at": "2022-09-04T14:36:42.559598Z",
"structure_string": "Ag3 Au1 S2\n1.0\n5.205971 -0.271068 -0.085865\n0.595012 5.198963 -0.133593\n0.359552 -0.179837 5.274729\nAg Au S\n3 1 2\ndirect\n0.749485 0.665639 0.081395 Ag\n0.353590 0.061652 0.293658 Ag\n-0.041502 0.271151 0.687803 Ag\n0.354579 0.667372 0.687302 Au\n0.085522 -0.063700 -0.041616 S\n0.623325 0.397883 0.416463 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"Au",
"S"
],
"chemical_system": "Ag-Au-S",
"density": 6.757869601332248,
"density_atomic": 0.04176168355600997,
"volume": 143.6723687624546,
"volume_molar": 14.42025380016881,
"formula_full": "Ag3 Au1 S2",
"formula_reduced": "Ag3AuS2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6203948916666667,
"spacegroup": 155
},
{
"id": "jvasp-12809",
"created_at": "2022-09-04T14:38:29.814272Z",
"updated_at": "2022-09-04T14:38:29.814304Z",
"structure_string": "Ag3 B1 O3\n1.0\n5.315430 -0.088374 -2.663857\n-4.290667 3.138755 -2.663857\n-0.029689 -0.088374 5.945506\nAg B O\n3 1 3\ndirect\n0.512447 0.000001 0.487555 Ag\n0.000001 0.487556 0.512447 Ag\n0.487555 0.512447 0.000001 Ag\n0.000000 0.000000 0.000000 B\n0.000001 0.863781 0.136222 O\n0.863780 0.136222 0.000001 O\n0.136222 0.000001 0.863781 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ag",
"B",
"O"
],
"chemical_system": "Ag-B-O",
"density": 6.725213299891916,
"density_atomic": 0.07413468552358321,
"volume": 94.4227381631397,
"volume_molar": 8.123243145186445,
"formula_full": "Ag3 B1 O3",
"formula_reduced": "Ag3BO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.637329266190476,
"spacegroup": 155
},
{
"id": "jvasp-18465",
"created_at": "2022-09-04T14:36:22.105784Z",
"updated_at": "2022-09-04T14:36:22.105803Z",
"structure_string": "Ag3 B1 O3\n1.0\n5.315365 -0.088503 -2.663874\n-4.290693 3.138614 -2.663874\n-0.029732 -0.088503 5.945456\nAg B O\n3 1 3\ndirect\n0.512460 0.000001 0.487543 Ag\n0.000000 0.487541 0.512459 Ag\n0.487542 0.512458 0.000001 Ag\n0.000000 0.000000 0.000000 B\n-0.000000 0.863777 0.136222 O\n0.863779 0.136223 0.000001 O\n0.136223 0.000001 0.863780 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ag",
"B",
"O"
],
"chemical_system": "Ag-B-O",
"density": 6.726172490017511,
"density_atomic": 0.0741452590556256,
"volume": 94.40927294823297,
"volume_molar": 8.122084724907415,
"formula_full": "Ag3 B1 O3",
"formula_reduced": "Ag3BO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.637329266190476,
"spacegroup": 155
},
{
"id": "jvasp-111113",
"created_at": "2022-09-04T14:38:38.933403Z",
"updated_at": "2022-09-04T14:38:38.933426Z",
"structure_string": "Ag3 Bi1\n1.0\n3.244130 -0.000000 0.000000\n-1.622064 2.809499 0.000000\n0.000000 0.000000 9.499270\nAg Bi\n3 1\ndirect\n0.666667 0.333333 0.500000 Ag\n0.333334 0.666667 0.273239 Ag\n0.333334 0.666667 0.726761 Ag\n0.666667 0.333333 -0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Bi"
],
"chemical_system": "Ag-Bi",
"density": 10.214583552539633,
"density_atomic": 0.046200069457031145,
"volume": 86.57995641587166,
"volume_molar": 13.034917113276107,
"formula_full": "Ag3 Bi1",
"formula_reduced": "Ag3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.06359902,
"spacegroup": 187
},
{
"id": "jvasp-112499",
"created_at": "2022-09-04T14:38:40.839001Z",
"updated_at": "2022-09-04T14:38:40.839025Z",
"structure_string": "Ag3 Bi3 S6\n1.0\n4.047350 0.000000 0.000000\n-2.023676 3.505108 0.000000\n-0.000000 -0.000000 19.001226\nAg Bi S\n3 3 6\ndirect\n0.333333 0.666667 0.666647 Ag\n0.666666 0.333334 0.333354 Ag\n0.000000 0.000000 0.000000 Ag\n0.666666 0.333334 0.833306 Bi\n0.333333 0.666667 0.166694 Bi\n0.000000 0.000000 0.500000 Bi\n0.666666 0.333334 0.586856 S\n0.000000 0.000000 0.746447 S\n0.333333 0.666667 0.920168 S\n0.000000 0.000000 0.253553 S\n0.666666 0.333334 0.079832 S\n0.333333 0.666667 0.413145 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"S"
],
"chemical_system": "Ag-Bi-S",
"density": 7.040721145050788,
"density_atomic": 0.044517160598581476,
"volume": 269.558970937207,
"volume_molar": 13.52768388420508,
"formula_full": "Ag3 Bi3 S6",
"formula_reduced": "AgBiS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.02461289,
"spacegroup": 166
},
{
"id": "jvasp-34889",
"created_at": "2022-09-04T14:38:34.281584Z",
"updated_at": "2022-09-04T14:38:34.281610Z",
"structure_string": "Ag3 Bi3 Se6\n1.0\n2.096436 -3.631135 0.000000\n2.096436 3.631135 -0.000000\n-0.000000 -0.000000 19.771433\nAg Bi Se\n3 3 6\ndirect\n0.333334 0.666668 0.333315 Ag\n0.666668 0.333334 0.666685 Ag\n0.000000 0.000000 0.000000 Ag\n0.333334 0.666668 0.833345 Bi\n0.000000 0.000000 0.500000 Bi\n0.666668 0.333334 0.166655 Bi\n0.666668 0.333334 0.411631 Se\n0.333334 0.666668 0.588369 Se\n0.666668 0.333334 0.921708 Se\n0.333334 0.666668 0.078292 Se\n0.000000 0.000000 0.744980 Se\n0.000000 0.000000 0.255020 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Se"
],
"chemical_system": "Ag-Bi-Se",
"density": 7.857062228711726,
"density_atomic": 0.03986475492922897,
"volume": 301.0177792715229,
"volume_molar": 15.106428650297676,
"formula_full": "Ag3 Bi3 Se6",
"formula_reduced": "AgBiSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7808470733333334,
"spacegroup": 166
},
{
"id": "jvasp-56537",
"created_at": "2022-09-04T14:37:35.610495Z",
"updated_at": "2022-09-04T14:37:35.610518Z",
"structure_string": "Ag3 Bi3 Te6\n1.0\n2.168844 -3.756548 -0.000000\n2.168844 3.756548 0.000000\n0.000000 -0.000000 21.894435\nAg Bi Te\n3 3 6\ndirect\n0.666666 0.333332 0.360278 Ag\n0.333332 0.666666 0.639723 Ag\n-0.000000 -0.000000 0.500000 Ag\n0.333332 0.666666 0.192464 Bi\n0.666666 0.333332 0.807536 Bi\n0.000000 0.000000 0.000000 Bi\n0.666666 0.333332 0.091462 Te\n0.333332 0.666666 0.908538 Te\n0.666666 0.333332 0.574754 Te\n0.333332 0.666666 0.425246 Te\n-0.000000 -0.000000 0.278826 Te\n-0.000000 -0.000000 0.721174 Te\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"Te"
],
"chemical_system": "Ag-Bi-Te",
"density": 7.987709894491007,
"density_atomic": 0.03363568294812225,
"volume": 356.76397647427325,
"volume_molar": 17.90402403687835,
"formula_full": "Ag3 Bi3 Te6",
"formula_reduced": "AgBiTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5943992733333334,
"spacegroup": 164
},
{
"id": "jvasp-85471",
"created_at": "2022-09-04T14:36:09.991551Z",
"updated_at": "2022-09-04T14:36:09.991571Z",
"structure_string": "Ag3 C6 N9\n1.0\n3.450248 0.000000 -0.000000\n-1.725124 2.988002 -0.000000\n-0.000000 -0.000000 24.780251\nAg C N\n3 6 9\ndirect\n0.000000 0.277937 0.666667 Ag\n0.277937 -0.000000 0.333333 Ag\n0.722064 0.722062 0.000000 Ag\n0.463466 0.383666 0.453915 C\n0.616334 0.079799 0.787248 C\n0.536536 0.920200 0.879418 C\n0.920202 0.536534 0.120582 C\n0.079800 0.616333 0.212752 C\n0.383667 0.463465 0.546085 C\n0.599243 0.842403 0.923638 N\n0.243162 0.400758 0.590305 N\n0.420864 0.999999 0.833333 N\n0.400758 0.243161 0.409695 N\n1.000001 0.420863 0.166667 N\n0.579138 0.579137 0.500000 N\n0.842405 0.599242 0.076362 N\n0.157597 0.756838 0.256972 N\n0.756839 0.157596 0.743028 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ag",
"C",
"N"
],
"chemical_system": "Ag-C-N",
"density": 3.3912301165315974,
"density_atomic": 0.07045885922991776,
"volume": 255.46822921533993,
"volume_molar": 8.547031311348452,
"formula_full": "Ag3 C6 N9",
"formula_reduced": "AgC2N3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.102924501666666,
"spacegroup": 152
}
]
}