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=nelements&page=516",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=514",
"results": [
{
"id": "jvasp-7771",
"created_at": "2022-09-04T14:37:02.923925Z",
"updated_at": "2022-09-04T14:37:02.923939Z",
"structure_string": "Lu2 O3\n1.0\n1.778066 -3.079700 -0.000000\n1.778066 3.079700 0.000000\n-0.000000 0.000000 5.719201\nLu O\n2 3\ndirect\n0.666668 0.333334 0.249402 Lu\n0.333334 0.666668 0.750598 Lu\n0.666668 0.333334 0.646198 O\n0.333334 0.666668 0.353802 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Lu",
"O"
],
"chemical_system": "Lu-O",
"density": 10.549613142527903,
"density_atomic": 0.07982673346088105,
"volume": 62.6356582967314,
"volume_molar": 7.5440150171635665,
"formula_full": "Lu2 O3",
"formula_reduced": "Lu2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3320343999999995,
"spacegroup": 164
},
{
"id": "jvasp-16042",
"created_at": "2022-09-04T14:37:01.799080Z",
"updated_at": "2022-09-04T14:37:01.799103Z",
"structure_string": "Ta1 F3\n1.0\n4.153072 -0.000000 0.000000\n-0.000000 4.153072 0.000000\n-0.000000 -0.000000 4.153072\nTa F\n1 3\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.500000 0.000000 F\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"F"
],
"chemical_system": "F-Ta",
"density": 5.515867343434502,
"density_atomic": 0.055840797264538895,
"volume": 71.63221508193182,
"volume_molar": 10.784482054349711,
"formula_full": "Ta1 F3",
"formula_reduced": "TaF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9327000118749996,
"spacegroup": 221
},
{
"id": "jvasp-30569",
"created_at": "2022-09-04T14:37:01.778293Z",
"updated_at": "2022-09-04T14:37:01.778317Z",
"structure_string": "Sn1 O2\n1.0\n2.808697 -0.192317 3.689465\n1.106727 2.588613 3.689465\n-0.314236 -0.192317 4.626248\nSn O\n1 2\ndirect\n0.500003 0.499997 0.500000 Sn\n0.756119 0.756112 0.756115 O\n0.243886 0.243882 0.243884 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.40830197139262,
"density_atomic": 0.07682039108064356,
"volume": 39.05213131303506,
"volume_molar": 7.839247724836693,
"formula_full": "Sn1 O2",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0149562333333335,
"spacegroup": 166
},
{
"id": "jvasp-16912",
"created_at": "2022-09-04T14:36:53.931752Z",
"updated_at": "2022-09-04T14:36:53.931776Z",
"structure_string": "Fe2 O4\n1.0\n1.432810 -2.481701 -0.000000\n1.432810 2.481701 -0.000000\n0.000000 -0.000000 11.023134\nFe O\n2 4\ndirect\n0.666667 0.333333 0.250000 Fe\n0.333333 0.666667 0.750000 Fe\n0.333333 0.666667 0.605507 O\n0.666667 0.333333 0.105507 O\n0.333333 0.666667 0.894493 O\n0.666667 0.333333 0.394493 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 3.721491792240069,
"density_atomic": 0.07653817600490616,
"volume": 78.39225224828189,
"volume_molar": 7.868152958876334,
"formula_full": "Fe2 O4",
"formula_reduced": "FeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.4018008333333336,
"spacegroup": 194
},
{
"id": "jvasp-7903",
"created_at": "2022-09-04T14:37:03.727605Z",
"updated_at": "2022-09-04T14:37:03.727633Z",
"structure_string": "P3 N5\n1.0\n2.636284 0.000128 0.000046\n-0.000229 4.422769 -0.000130\n-1.318114 -2.211263 6.479117\nP N\n3 5\ndirect\n0.318301 0.865718 0.636593 P\n0.681706 0.229125 0.363408 P\n-0.000005 0.691760 0.000000 P\n0.223679 0.499948 0.447351 N\n0.776330 0.052599 0.552651 N\n0.896054 0.812839 0.792112 N\n0.499988 0.493690 0.000001 N\n0.103945 0.020727 0.207889 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"P",
"N"
],
"chemical_system": "N-P",
"density": 3.581927227187193,
"density_atomic": 0.10589867528850465,
"volume": 75.54391004613827,
"volume_molar": 5.686700748232783,
"formula_full": "P3 N5",
"formula_reduced": "P3N5",
"formula_anonymous": "A3B5",
"energy_above_hull": 5.02184284375,
"spacegroup": 44
},
{
"id": "jvasp-29325",
"created_at": "2022-09-04T14:37:01.762412Z",
"updated_at": "2022-09-04T14:37:01.762440Z",
"structure_string": "Y2 Cl2\n1.0\n3.683964 0.013559 8.755002\n1.777920 3.226574 8.755002\n0.022856 0.013559 9.498479\nY Cl\n2 2\ndirect\n0.217559 0.217559 0.217559 Y\n0.782441 0.782441 0.782441 Y\n0.386680 0.386680 0.386680 Cl\n0.613320 0.613320 0.613320 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Y",
"Cl"
],
"chemical_system": "Cl-Y",
"density": 3.693938156085956,
"density_atomic": 0.035776167988642575,
"volume": 111.8062728593468,
"volume_molar": 16.832827825248852,
"formula_full": "Y2 Cl2",
"formula_reduced": "YCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.23322975875,
"spacegroup": 166
},
{
"id": "jvasp-19831",
"created_at": "2022-09-04T14:36:53.944565Z",
"updated_at": "2022-09-04T14:36:53.944591Z",
"structure_string": "Mn2 Sb2\n1.0\n2.040527 -3.534296 0.000000\n2.040527 3.534296 0.000000\n0.000000 0.000000 5.623806\nMn Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.333334 0.666668 0.250000 Sb\n0.666668 0.333334 0.750000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Sb"
],
"chemical_system": "Mn-Sb",
"density": 7.234445450602106,
"density_atomic": 0.049312202451502266,
"volume": 81.11582531593339,
"volume_molar": 12.21227294790306,
"formula_full": "Mn2 Sb2",
"formula_reduced": "MnSb",
"formula_anonymous": "AB",
"energy_above_hull": 1.9724066706896548,
"spacegroup": 194
},
{
"id": "jvasp-14947",
"created_at": "2022-09-04T14:36:53.949671Z",
"updated_at": "2022-09-04T14:36:53.949691Z",
"structure_string": "Sm2 Tl2\n1.0\n4.352756 0.000000 0.000000\n-0.000000 5.075672 0.000000\n0.000000 0.000000 5.075672\nSm Tl\n2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.500000 0.500000 Sm\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Tl"
],
"chemical_system": "Sm-Tl",
"density": 10.506108299614938,
"density_atomic": 0.035670448485961494,
"volume": 112.13764249625976,
"volume_molar": 16.882716690175855,
"formula_full": "Sm2 Tl2",
"formula_reduced": "SmTl",
"formula_anonymous": "AB",
"energy_above_hull": 0.2110112916666666,
"spacegroup": 123
},
{
"id": "jvasp-78887",
"created_at": "2022-09-04T14:36:44.318872Z",
"updated_at": "2022-09-04T14:36:44.318893Z",
"structure_string": "La1 Cd2\n1.0\n5.116137 0.000000 0.000000\n-2.558069 4.430704 -0.000000\n-0.000000 -0.000000 3.527975\nLa Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.333333 0.666666 0.499961 Cd\n0.666667 0.333333 0.500038 Cd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"La",
"Cd"
],
"chemical_system": "Cd-La",
"density": 7.55239676376665,
"density_atomic": 0.03751291845168199,
"volume": 79.97245012712379,
"volume_molar": 16.053511719587313,
"formula_full": "La1 Cd2",
"formula_reduced": "LaCd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-16214",
"created_at": "2022-09-04T14:36:45.238032Z",
"updated_at": "2022-09-04T14:36:45.238060Z",
"structure_string": "Hf4 P4\n1.0\n1.837484 -3.182614 0.000000\n1.837484 3.182614 0.000000\n-0.000000 0.000000 12.408305\nHf P\n4 4\ndirect\n0.333332 0.666666 0.616307 Hf\n0.666666 0.333332 0.116307 Hf\n0.666666 0.333332 0.383693 Hf\n0.333332 0.666666 0.883693 Hf\n0.666666 0.333332 0.750000 P\n0.333332 0.666666 0.250000 P\n0.000000 0.000000 0.500000 P\n0.000000 0.000000 0.000000 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hf",
"P"
],
"chemical_system": "Hf-P",
"density": 9.586674842385893,
"density_atomic": 0.055123907629568605,
"volume": 145.12759243702055,
"volume_molar": 10.924734872695616,
"formula_full": "Hf4 P4",
"formula_reduced": "HfP",
"formula_anonymous": "AB",
"energy_above_hull": 2.14794425,
"spacegroup": 194
},
{
"id": "jvasp-36357",
"created_at": "2022-09-04T14:36:44.319354Z",
"updated_at": "2022-09-04T14:36:44.319381Z",
"structure_string": "Pb1 S1\n1.0\n2.024092 -3.505830 0.000000\n2.024092 3.505830 -0.000000\n-0.000000 0.000000 3.799572\nPb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.333333 0.666667 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.3678791848154646,
"density_atomic": 0.0370889228002142,
"volume": 53.92445638751335,
"volume_molar": 16.237033338604327,
"formula_full": "Pb1 S1",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4619104099999999,
"spacegroup": 187
},
{
"id": "jvasp-4343",
"created_at": "2022-09-04T14:37:02.904482Z",
"updated_at": "2022-09-04T14:37:02.904500Z",
"structure_string": "S10 N12\n1.0\n6.963451 0.017445 -1.220037\n-1.906727 6.697339 -1.220037\n0.015284 0.020295 7.369882\nS N\n10 12\ndirect\n0.922627 0.077372 0.749999 S\n0.756919 0.326190 0.498452 S\n0.673809 0.243080 0.001547 S\n0.243080 0.673810 0.501547 S\n0.326190 0.756919 -0.001548 S\n0.719251 0.577714 0.830175 S\n0.422286 0.280749 0.669823 S\n0.280748 0.422286 0.169823 S\n0.577713 0.719251 0.330176 S\n0.077371 0.922628 0.249999 S\n0.841552 0.124154 0.929506 N\n0.238534 0.520028 -0.010161 N\n0.158447 0.875846 0.070493 N\n0.830794 0.531464 0.661409 N\n0.468535 0.169206 0.838589 N\n0.169205 0.468536 0.338589 N\n0.531464 0.830794 0.161410 N\n0.520028 0.238534 0.489839 N\n0.761466 0.479971 0.010160 N\n0.479971 0.761466 0.510160 N\n0.124153 0.841553 0.429506 N\n0.875846 0.158447 0.570493 N\n",
"nsites": 22,
"nelements": 2,
"elements": [
"S",
"N"
],
"chemical_system": "N-S",
"density": 2.3571492740664803,
"density_atomic": 0.06389859602853536,
"volume": 344.29551457085853,
"volume_molar": 9.42452750810155,
"formula_full": "S10 N12",
"formula_reduced": "S5N6",
"formula_anonymous": "A5B6",
"energy_above_hull": 4.503487227272728,
"spacegroup": 15
}
]
}