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=-energy_above_hull&page=3449",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3447",
"results": [
{
"id": "jvasp-90814",
"created_at": "2022-09-04T14:38:14.802471Z",
"updated_at": "2022-09-04T14:38:14.802497Z",
"structure_string": "Ag4 O4\n1.0\n0.000000 3.567828 0.000000\n0.015635 0.000000 5.601368\n5.528014 0.000000 -1.781154\nAg O\n4 4\ndirect\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Ag\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500001 0.500000 Ag\n0.169148 0.717392 0.290860 O\n0.669148 0.782609 0.709140 O\n0.830853 0.282609 0.709140 O\n0.330852 0.217392 0.290860 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ag",
"O"
],
"chemical_system": "Ag-O",
"density": 7.4406221071448035,
"density_atomic": 0.07234898179455913,
"volume": 110.57515671356173,
"volume_molar": 8.323739478601595,
"formula_full": "Ag4 O4",
"formula_reduced": "AgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.6107753799999999,
"spacegroup": 14
},
{
"id": "jvasp-115045",
"created_at": "2022-09-04T14:38:44.810088Z",
"updated_at": "2022-09-04T14:38:44.810110Z",
"structure_string": "Sr1 Ge1 S1\n1.0\n3.835124 -0.000000 0.000000\n0.000000 3.835124 -0.000000\n-0.000000 0.000000 7.875334\nSr Ge S\n1 1 1\ndirect\n0.000000 -0.000000 0.001200 Sr\n0.000000 -0.000000 0.388253 Ge\n0.000000 -0.000000 0.656014 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ge",
"S"
],
"chemical_system": "Ge-S-Sr",
"density": 2.7571286811025466,
"density_atomic": 0.025899623580039954,
"volume": 115.83179928190185,
"volume_molar": 23.251846658656,
"formula_full": "Sr1 Ge1 S1",
"formula_reduced": "SrGeS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6105240866666666,
"spacegroup": 99
},
{
"id": "jvasp-29407",
"created_at": "2022-09-04T14:36:40.026730Z",
"updated_at": "2022-09-04T14:36:40.026756Z",
"structure_string": "Hg6 As2 S8 Br2\n1.0\n7.572386 -0.000000 -0.000000\n-3.786193 6.557878 0.000000\n-0.000000 -0.000000 9.340316\nHg As S Br\n6 2 8 2\ndirect\n0.495588 0.991175 0.245249 Hg\n0.991175 0.495587 0.745249 Hg\n0.008826 0.504413 0.245249 Hg\n0.504413 0.495587 0.745249 Hg\n0.504413 0.008826 0.745249 Hg\n0.495588 0.504413 0.245249 Hg\n0.000000 0.000000 0.728365 As\n0.000000 0.000000 0.228364 As\n0.333334 0.666667 0.104647 S\n0.148488 0.851513 0.862566 S\n0.851513 0.703026 0.362566 S\n0.296974 0.148488 0.362566 S\n0.703027 0.851513 0.862566 S\n0.851513 0.148488 0.362566 S\n0.666668 0.333333 0.604648 S\n0.148488 0.296974 0.862566 S\n0.666668 0.333333 0.023549 Br\n0.333334 0.666667 0.523549 Br\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Hg",
"As",
"S",
"Br"
],
"chemical_system": "As-Br-Hg-S",
"density": 6.335688995410805,
"density_atomic": 0.03880742785559473,
"volume": 463.82873059712466,
"volume_molar": 15.518010578822242,
"formula_full": "Hg6 As2 S8 Br2",
"formula_reduced": "Hg3AsS4Br",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.6104788505555556,
"spacegroup": 186
},
{
"id": "jvasp-113780",
"created_at": "2022-09-04T14:38:51.528962Z",
"updated_at": "2022-09-04T14:38:51.528986Z",
"structure_string": "In1 Bi3\n1.0\n4.741454 0.034860 0.000000\n-3.588117 3.099681 0.000000\n0.000000 0.000000 8.826401\nIn Bi\n1 3\ndirect\n0.499999 0.500000 0.000000 In\n0.000000 0.000000 0.500000 Bi\n-0.000000 0.500000 0.757347 Bi\n0.500000 -0.000000 0.242653 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 9.414978449431526,
"density_atomic": 0.030575057508925765,
"volume": 130.8255920314224,
"volume_molar": 19.696253255589003,
"formula_full": "In1 Bi3",
"formula_reduced": "InBi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6104278666666667,
"spacegroup": 21
},
{
"id": "jvasp-120261",
"created_at": "2022-09-04T14:38:52.610922Z",
"updated_at": "2022-09-04T14:38:52.610951Z",
"structure_string": "Ge3 I1\n1.0\n4.593680 -0.736811 0.529654\n3.928038 -6.855997 1.121821\n0.608872 0.920788 -3.938272\nGe I\n3 1\ndirect\n0.831362 0.114066 0.042917 Ge\n0.404650 0.673798 0.822489 Ge\n0.979240 0.233727 0.602203 Ge\n0.905235 0.673728 0.322487 I\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ge",
"I"
],
"chemical_system": "Ge-I",
"density": 5.1347754151524265,
"density_atomic": 0.03587023894414622,
"volume": 111.51305700049632,
"volume_molar": 16.788683145872305,
"formula_full": "Ge3 I1",
"formula_reduced": "Ge3I",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6102587187499999,
"spacegroup": 12
},
{
"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-16297",
"created_at": "2022-09-04T14:37:49.620062Z",
"updated_at": "2022-09-04T14:37:49.620077Z",
"structure_string": "Ba3 Al2 Ge2\n1.0\n4.262379 0.000000 -0.904002\n-0.264925 4.971859 -1.249126\n0.019693 0.012319 10.593434\nBa Al Ge\n3 2 2\ndirect\n0.814921 0.814928 0.629844 Ba\n0.500000 -0.000000 0.000000 Ba\n0.185078 0.185072 0.370156 Ba\n0.934948 0.434955 0.869898 Al\n0.065051 0.565046 0.130102 Al\n0.363925 0.363936 0.727852 Ge\n0.636073 0.636065 0.272148 Ge\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ge"
],
"chemical_system": "Al-Ba-Ge",
"density": 4.517916536723504,
"density_atomic": 0.031159228252401205,
"volume": 224.65254733838162,
"volume_molar": 19.326989459489965,
"formula_full": "Ba3 Al2 Ge2",
"formula_reduced": "Ba3(AlGe)2",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.6101936299999999,
"spacegroup": 71
},
{
"id": "jvasp-76249",
"created_at": "2022-09-04T14:37:04.305249Z",
"updated_at": "2022-09-04T14:37:04.305269Z",
"structure_string": "Tb4 Mg2 Ge4\n1.0\n-0.000000 -0.000000 4.252242\n7.266039 0.000000 0.000000\n-0.000000 7.266039 0.000000\nTb Mg Ge\n4 2 4\ndirect\n0.500000 0.177407 0.677407 Tb\n0.500000 0.822593 0.322593 Tb\n0.500000 0.322593 0.177407 Tb\n0.500000 0.677407 0.822593 Tb\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.375944 0.875944 Ge\n0.000000 0.624057 0.124057 Ge\n0.000000 0.124057 0.375944 Ge\n0.000000 0.875944 0.624057 Ge\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Ge"
],
"chemical_system": "Ge-Mg-Tb",
"density": 7.210792612773039,
"density_atomic": 0.04454372968608368,
"volume": 224.49848879906867,
"volume_molar": 13.51961499955275,
"formula_full": "Tb4 Mg2 Ge4",
"formula_reduced": "Tb2MgGe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6097475499999999,
"spacegroup": 127
},
{
"id": "jvasp-95339",
"created_at": "2022-09-04T14:36:17.891395Z",
"updated_at": "2022-09-04T14:36:17.891422Z",
"structure_string": "La1 Ga3 Pd2\n1.0\n5.474339 0.000000 -0.000000\n-2.737170 4.740917 -0.000000\n-0.000000 -0.000000 4.324130\nLa Ga Pd\n1 3 2\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 -0.000000 0.500000 Ga\n0.500000 0.500000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.666667 0.333333 0.000000 Pd\n0.333333 0.666667 0.000000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Ga",
"Pd"
],
"chemical_system": "Ga-La-Pd",
"density": 8.299519684264615,
"density_atomic": 0.05346363319488397,
"volume": 112.22581858829136,
"volume_molar": 11.263994607415249,
"formula_full": "La1 Ga3 Pd2",
"formula_reduced": "LaGa3Pd2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6094362458333331,
"spacegroup": 191
},
{
"id": "jvasp-57449",
"created_at": "2022-09-04T14:38:33.629899Z",
"updated_at": "2022-09-04T14:38:33.629927Z",
"structure_string": "K1 Sn1 S2\n1.0\n3.523856 -0.240468 6.893146\n1.470436 3.211418 6.893146\n-0.404236 -0.240468 7.731081\nK Sn S\n1 1 2\ndirect\n0.500001 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Sn\n0.264444 0.264443 0.264444 S\n0.735557 0.735556 0.735556 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Sn",
"S"
],
"chemical_system": "K-S-Sn",
"density": 3.5695318021215683,
"density_atomic": 0.038742700952654294,
"volume": 103.24525398702119,
"volume_molar": 15.543936307794821,
"formula_full": "K1 Sn1 S2",
"formula_reduced": "KSnS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6093424249999999,
"spacegroup": 166
},
{
"id": "jvasp-1978",
"created_at": "2022-09-04T14:36:07.159504Z",
"updated_at": "2022-09-04T14:36:07.159532Z",
"structure_string": "Sr2 Br1 N1\n1.0\n3.806815 0.007422 6.648678\n1.774409 3.367992 6.648678\n0.012271 0.007422 7.661371\nSr Br N\n2 1 1\ndirect\n0.772322 0.772321 0.772324 Sr\n0.227678 0.227677 0.227678 Sr\n0.000000 0.000000 0.000000 Br\n0.500000 0.499999 0.500001 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Br",
"N"
],
"chemical_system": "Br-N-Sr",
"density": 4.572061921102548,
"density_atomic": 0.04091923292316249,
"volume": 97.75354312020312,
"volume_molar": 14.717139911464821,
"formula_full": "Sr2 Br1 N1",
"formula_reduced": "Sr2BrN",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6091674937499999,
"spacegroup": 166
},
{
"id": "jvasp-71236",
"created_at": "2022-09-04T14:35:58.680045Z",
"updated_at": "2022-09-04T14:35:58.680067Z",
"structure_string": "Be1 Cu1 Sn2\n1.0\n3.092437 0.000000 -0.000000\n0.000000 3.092437 0.000000\n0.000000 -0.000000 8.157123\nBe Cu Sn\n1 1 2\ndirect\n0.000000 0.000000 0.572905 Be\n0.500000 0.500000 0.675304 Cu\n0.000000 0.000000 0.920706 Sn\n0.500000 0.500000 0.331085 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Sn"
],
"chemical_system": "Be-Cu-Sn",
"density": 6.59844333729528,
"density_atomic": 0.05127684062332942,
"volume": 78.0079262172818,
"volume_molar": 11.744367801904133,
"formula_full": "Be1 Cu1 Sn2",
"formula_reduced": "BeCuSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6090724875,
"spacegroup": 99
}
]
}