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=-density_atomic&page=4588",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=4586",
"results": [
{
"id": "jvasp-114539",
"created_at": "2022-09-04T14:38:41.609850Z",
"updated_at": "2022-09-04T14:38:41.609872Z",
"structure_string": "Ba1 Br1 N1\n1.0\n4.569725 0.000000 -0.000000\n0.000000 4.569725 0.000000\n-0.000000 -0.000000 7.206624\nBa Br N\n1 1 1\ndirect\n0.000000 0.000000 0.304843 Ba\n0.000000 0.000000 0.735197 Br\n0.000000 0.000000 -0.010316 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Br",
"N"
],
"chemical_system": "Ba-Br-N",
"density": 2.5515010044534843,
"density_atomic": 0.019934679600355294,
"volume": 150.49150827317692,
"volume_molar": 30.209368200192532,
"formula_full": "Ba1 Br1 N1",
"formula_reduced": "BaBrN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6421444416666662,
"spacegroup": 99
},
{
"id": "jvasp-102457",
"created_at": "2022-09-04T14:36:47.704933Z",
"updated_at": "2022-09-04T14:36:47.704957Z",
"structure_string": "Ba6 Nd2\n1.0\n8.349926 -0.000000 0.000000\n-4.174963 7.231248 0.000000\n-0.000000 -0.000000 6.658761\nBa Nd\n6 2\ndirect\n0.828429 0.171572 0.750000 Ba\n0.343144 0.171572 0.750000 Ba\n0.828429 0.656857 0.750000 Ba\n0.171572 0.828428 0.250000 Ba\n0.656857 0.828428 0.250000 Ba\n0.171572 0.343144 0.250000 Ba\n0.666667 0.333333 0.250000 Nd\n0.333334 0.666667 0.750000 Nd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Nd"
],
"chemical_system": "Ba-Nd",
"density": 4.594504975871974,
"density_atomic": 0.01989759912609379,
"volume": 402.0585573818687,
"volume_molar": 30.26566532895188,
"formula_full": "Ba6 Nd2",
"formula_reduced": "Ba3Nd",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2574848525,
"spacegroup": 194
},
{
"id": "jvasp-120853",
"created_at": "2022-09-04T14:38:50.726004Z",
"updated_at": "2022-09-04T14:38:50.726030Z",
"structure_string": "Ba1 Cd1 Cl1\n1.0\n4.076069 0.000000 0.000000\n-0.000000 4.076069 -0.000000\n0.000000 -0.000000 9.076814\nBa Cd Cl\n1 1 1\ndirect\n0.000000 0.000000 0.281350 Ba\n0.000000 0.000000 0.672236 Cd\n0.000000 0.000000 -0.029107 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Cl"
],
"chemical_system": "Ba-Cd-Cl",
"density": 3.140280360344879,
"density_atomic": 0.01989320528599678,
"volume": 150.805260231832,
"volume_molar": 30.272350148817416,
"formula_full": "Ba1 Cd1 Cl1",
"formula_reduced": "BaCdCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1309833333333333,
"spacegroup": 99
},
{
"id": "jvasp-102369",
"created_at": "2022-09-04T14:36:59.791443Z",
"updated_at": "2022-09-04T14:36:59.791462Z",
"structure_string": "K3 Bi1 I6\n1.0\n7.729720 -0.000000 4.462756\n2.576573 7.287650 4.462756\n-0.000000 -0.000000 8.925512\nK Bi I\n3 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Bi\n0.757698 0.242302 0.242302 I\n0.242301 0.242302 0.757699 I\n0.242301 0.757699 0.757699 I\n0.242301 0.757699 0.242302 I\n0.757698 0.242302 0.757699 I\n0.757698 0.757699 0.242302 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Bi",
"I"
],
"chemical_system": "Bi-I-K",
"density": 3.5923170950541228,
"density_atomic": 0.01988912112118186,
"volume": 502.7874253000565,
"volume_molar": 30.27856647514926,
"formula_full": "K3 Bi1 I6",
"formula_reduced": "K3BiI6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64710",
"created_at": "2022-09-04T14:36:18.545624Z",
"updated_at": "2022-09-04T14:36:18.545650Z",
"structure_string": "Ba1 Sr1 Cl1\n1.0\n-0.000000 4.229067 4.229067\n4.229067 0.000000 4.229067\n4.229067 4.229067 0.000000\nBa Sr Cl\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Cl"
],
"chemical_system": "Ba-Cl-Sr",
"density": 2.8584222571727045,
"density_atomic": 0.019831591232902852,
"volume": 151.27379163718646,
"volume_molar": 30.366402217934926,
"formula_full": "Ba1 Sr1 Cl1",
"formula_reduced": "BaSrCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1778166666666664,
"spacegroup": 216
},
{
"id": "jvasp-64569",
"created_at": "2022-09-04T14:36:14.885264Z",
"updated_at": "2022-09-04T14:36:14.885282Z",
"structure_string": "K1 Ba4 Mn1\n1.0\n-0.000000 5.328633 5.328633\n5.328633 0.000000 5.328633\n5.328633 5.328633 0.000000\nK Ba Mn\n1 4 1\ndirect\n0.250000 0.250000 0.250000 K\n0.119193 0.626936 0.626936 Ba\n0.626936 0.626936 0.626936 Ba\n0.626936 0.119193 0.626936 Ba\n0.626936 0.626936 0.119193 Ba\n0.000000 0.000000 0.000000 Mn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Ba",
"Mn"
],
"chemical_system": "Ba-K-Mn",
"density": 3.530328832220056,
"density_atomic": 0.019827767816063713,
"volume": 302.6059239577652,
"volume_molar": 30.372257814725305,
"formula_full": "K1 Ba4 Mn1",
"formula_reduced": "KBa4Mn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6102298535632182,
"spacegroup": 216
},
{
"id": "jvasp-50953",
"created_at": "2022-09-04T14:36:44.325549Z",
"updated_at": "2022-09-04T14:36:44.325565Z",
"structure_string": "Ba2 Sr1 I6\n1.0\n8.579717 -0.000000 0.000421\n-4.289858 7.429681 -0.000211\n0.000050 0.000000 7.136588\nBa Sr I\n2 1 6\ndirect\n0.333321 0.666664 0.499997 Ba\n0.666657 0.333336 0.499997 Ba\n0.999989 0.000000 0.999991 Sr\n-0.000005 0.670823 0.763592 I\n-0.000017 0.329166 0.236413 I\n0.329172 0.329177 0.763592 I\n0.670817 0.670834 0.236413 I\n0.329135 0.000000 0.236485 I\n0.670834 0.000000 0.763519 I\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"I"
],
"chemical_system": "Ba-I-Sr",
"density": 4.101720277303512,
"density_atomic": 0.019783756310637696,
"volume": 454.9186645187655,
"volume_molar": 30.439824800924708,
"formula_full": "Ba2 Sr1 I6",
"formula_reduced": "Ba2SrI6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0105755555555555,
"spacegroup": 162
},
{
"id": "jvasp-118708",
"created_at": "2022-09-04T14:38:50.028880Z",
"updated_at": "2022-09-04T14:38:50.028909Z",
"structure_string": "Mg1 Si1 O1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nMg Si O\n1 1 1\ndirect\n0.000000 0.000000 0.221837 Mg\n0.000000 0.000000 0.771644 Si\n0.000000 0.000000 0.027450 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Si",
"O"
],
"chemical_system": "Mg-O-Si",
"density": 0.7484066096791894,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "Mg1 Si1 O1",
"formula_reduced": "MgSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5900137166666666,
"spacegroup": 99
},
{
"id": "jvasp-114819",
"created_at": "2022-09-04T14:38:43.973679Z",
"updated_at": "2022-09-04T14:38:43.973705Z",
"structure_string": "Co1 Se1 O1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nCo Se O\n1 1 1\ndirect\n0.000000 0.000000 -0.023582 Co\n0.000000 0.000000 0.743924 Se\n0.000000 0.000000 0.233253 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Co",
"Se",
"O"
],
"chemical_system": "Co-O-Se",
"density": 1.684082522107542,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "Co1 Se1 O1",
"formula_reduced": "CoSeO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.687039255555556,
"spacegroup": 99
},
{
"id": "jvasp-121243",
"created_at": "2022-09-04T14:38:50.035526Z",
"updated_at": "2022-09-04T14:38:50.035551Z",
"structure_string": "Sr1 Si1 N1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nSr Si N\n1 1 1\ndirect\n0.000000 0.000000 0.708884 Sr\n0.000000 0.000000 -0.037776 Si\n0.000000 0.000000 0.207089 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Si",
"N"
],
"chemical_system": "N-Si-Sr",
"density": 1.4194708258972297,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "Sr1 Si1 N1",
"formula_reduced": "SrSiN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.278552719999999,
"spacegroup": 99
},
{
"id": "jvasp-118082",
"created_at": "2022-09-04T14:38:52.535665Z",
"updated_at": "2022-09-04T14:38:52.535690Z",
"structure_string": "S1 N1 Cl1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nS N Cl\n1 1 1\ndirect\n0.000000 0.000000 0.780247 S\n0.000000 0.000000 0.024351 N\n0.000000 0.000000 0.203154 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"S",
"N",
"Cl"
],
"chemical_system": "Cl-N-S",
"density": 0.8921437863209774,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "S1 N1 Cl1",
"formula_reduced": "SNCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.827939105833333,
"spacegroup": 99
},
{
"id": "jvasp-121004",
"created_at": "2022-09-04T14:38:54.200222Z",
"updated_at": "2022-09-04T14:38:54.200252Z",
"structure_string": "H1 O1 F1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nH O F\n1 1 1\ndirect\n0.000000 0.000000 -0.003292 H\n0.000000 0.000000 0.846639 O\n0.000000 0.000000 0.152541 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"O",
"F"
],
"chemical_system": "F-H-O",
"density": 0.39401923671904077,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "H1 O1 F1",
"formula_reduced": "HOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5593312608333334,
"spacegroup": 99
}
]
}