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=3652",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3650",
"results": [
{
"id": "jvasp-105162",
"created_at": "2022-09-04T14:36:59.357403Z",
"updated_at": "2022-09-04T14:36:59.357420Z",
"structure_string": "Er2 Ag1 Hg1\n1.0\n4.438180 -0.000000 2.562385\n1.479393 4.184357 2.562385\n-0.000000 -0.000000 5.124769\nEr Ag Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Er\n0.749999 0.750001 0.749999 Er\n0.499999 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Ag",
"Hg"
],
"chemical_system": "Ag-Er-Hg",
"density": 11.218532705332782,
"density_atomic": 0.04202929010157748,
"volume": 95.17172406035638,
"volume_molar": 14.328437966583621,
"formula_full": "Er2 Ag1 Hg1",
"formula_reduced": "Er2AgHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4068621574999999,
"spacegroup": 225
},
{
"id": "jvasp-119015",
"created_at": "2022-09-04T14:38:51.058230Z",
"updated_at": "2022-09-04T14:38:51.058269Z",
"structure_string": "Mg16 Sc1 Al12\n1.0\n8.622988 0.010100 2.992685\n-4.286683 7.482003 2.992685\n-0.008907 -0.015390 8.962840\nMg Sc Al\n16 1 12\ndirect\n0.399664 0.399663 0.281656 Mg\n0.314390 0.605430 0.996959 Mg\n0.000553 0.318962 0.393649 Mg\n0.996286 0.335456 0.007752 Mg\n0.290230 0.684243 0.315605 Mg\n0.599645 0.001867 0.685202 Mg\n0.001867 0.599644 0.685202 Mg\n0.684244 0.290230 0.315605 Mg\n0.398856 0.714410 0.604053 Mg\n0.318962 0.000553 0.393649 Mg\n0.714410 0.398856 0.604053 Mg\n0.605430 0.314390 0.996959 Mg\n-0.000529 -0.000529 0.002526 Mg\n0.656774 0.656774 0.348896 Mg\n0.004889 0.004889 0.649809 Mg\n0.335456 0.996286 0.007752 Mg\n0.684839 0.684838 0.720655 Sc\n0.179230 0.364998 0.633617 Al\n0.822224 0.184741 0.811426 Al\n0.634126 0.000604 0.181514 Al\n0.000604 0.634125 0.181514 Al\n0.184741 0.822224 0.811426 Al\n0.184124 0.184124 0.180873 Al\n0.995588 0.810267 0.372900 Al\n0.812375 0.632713 0.997365 Al\n0.372924 0.372924 0.815491 Al\n0.810267 0.995588 0.372900 Al\n0.364998 0.179230 0.633617 Al\n0.632713 0.812374 0.997365 Al\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Al"
],
"chemical_system": "Al-Mg-Sc",
"density": 2.1711474674012154,
"density_atomic": 0.050048379052173984,
"volume": 579.4393454734736,
"volume_molar": 12.032638966632852,
"formula_full": "Mg16 Sc1 Al12",
"formula_reduced": "Mg16ScAl12",
"formula_anonymous": "AB12C16",
"energy_above_hull": 0.4068152982758624,
"spacegroup": 8
},
{
"id": "jvasp-17380",
"created_at": "2022-09-04T14:38:30.592856Z",
"updated_at": "2022-09-04T14:38:30.592882Z",
"structure_string": "Ba2 Cu2 P2\n1.0\n2.118886 -3.670019 -0.000000\n2.118886 3.670019 -0.000000\n-0.000000 -0.000000 9.201026\nBa Cu P\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666668 0.750000 Cu\n0.666668 0.333334 0.250000 Cu\n0.666668 0.333334 0.750000 P\n0.333334 0.666668 0.250000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"P"
],
"chemical_system": "Ba-Cu-P",
"density": 5.380689983994759,
"density_atomic": 0.04192847750110454,
"volume": 143.10083164460096,
"volume_molar": 14.36288918394749,
"formula_full": "Ba2 Cu2 P2",
"formula_reduced": "BaCuP",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4065939733333333,
"spacegroup": 194
},
{
"id": "jvasp-65277",
"created_at": "2022-09-04T14:36:07.371376Z",
"updated_at": "2022-09-04T14:36:07.371385Z",
"structure_string": "Na4 Sc1 Be1\n1.0\n0.000000 4.234062 4.234062\n4.234062 -0.000000 4.234062\n4.234062 4.234062 0.000000\nNa Sc Be\n4 1 1\ndirect\n0.122178 0.625940 0.625940 Na\n0.625940 0.625940 0.625940 Na\n0.625940 0.122178 0.625940 Na\n0.625940 0.625940 0.122178 Na\n0.250000 0.250000 0.250000 Sc\n0.000000 0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Sc",
"Be"
],
"chemical_system": "Be-Na-Sc",
"density": 1.5961864721810448,
"density_atomic": 0.03952297386796874,
"volume": 151.81043865888543,
"volume_molar": 15.237063840685895,
"formula_full": "Na4 Sc1 Be1",
"formula_reduced": "Na4ScBe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4064462249999998,
"spacegroup": 216
},
{
"id": "jvasp-105933",
"created_at": "2022-09-04T14:35:48.365503Z",
"updated_at": "2022-09-04T14:35:48.365529Z",
"structure_string": "Li1 Mg1 Sb1\n1.0\n4.067381 0.000000 2.348304\n1.355793 3.834764 2.348304\n0.000000 -0.000000 4.696608\nLi Mg Sb\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Sb"
],
"chemical_system": "Li-Mg-Sb",
"density": 3.468324696559007,
"density_atomic": 0.04095278524622689,
"volume": 73.25509075787218,
"volume_molar": 14.705082264349379,
"formula_full": "Li1 Mg1 Sb1",
"formula_reduced": "LiMgSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4064066944444448,
"spacegroup": 216
},
{
"id": "jvasp-23447",
"created_at": "2022-09-04T14:37:40.005377Z",
"updated_at": "2022-09-04T14:37:40.005394Z",
"structure_string": "Yb4 Sb4 Pd4\n1.0\n4.655863 -0.000000 0.000000\n0.000000 7.261418 0.000000\n0.000000 0.000000 7.927010\nYb Sb Pd\n4 4 4\ndirect\n0.250000 0.492802 0.206774 Yb\n0.750000 0.507198 0.793226 Yb\n0.250000 0.992802 0.293226 Yb\n0.750000 0.007198 0.706774 Yb\n0.250000 0.298607 0.591626 Sb\n0.750000 0.201393 0.091626 Sb\n0.250000 0.798608 0.908374 Sb\n0.750000 0.701393 0.408374 Sb\n0.750000 0.307192 0.419676 Pd\n0.250000 0.192808 0.919676 Pd\n0.750000 0.807192 0.080324 Pd\n0.250000 0.692808 0.580324 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Yb",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Yb",
"density": 9.943988795513627,
"density_atomic": 0.04477650685145849,
"volume": 267.99768101180337,
"volume_molar": 13.449331320055492,
"formula_full": "Yb4 Sb4 Pd4",
"formula_reduced": "YbSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4063841666666666,
"spacegroup": 62
},
{
"id": "jvasp-64162",
"created_at": "2022-09-04T14:36:12.222326Z",
"updated_at": "2022-09-04T14:36:12.222359Z",
"structure_string": "Ba4 Be1 Bi1\n1.0\n-0.000000 5.006229 5.006229\n5.006229 0.000000 5.006229\n5.006229 5.006229 -0.000000\nBa Be Bi\n4 1 1\ndirect\n0.122115 0.625962 0.625962 Ba\n0.625962 0.625962 0.625962 Ba\n0.625962 0.122115 0.625962 Ba\n0.625962 0.625962 0.122115 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Be",
"Bi"
],
"chemical_system": "Ba-Be-Bi",
"density": 5.077529957415216,
"density_atomic": 0.023910525427364944,
"volume": 250.93551449660592,
"volume_molar": 25.186149833026356,
"formula_full": "Ba4 Be1 Bi1",
"formula_reduced": "Ba4BeBi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4063823799999999,
"spacegroup": 216
},
{
"id": "jvasp-113060",
"created_at": "2022-09-04T14:38:46.403517Z",
"updated_at": "2022-09-04T14:38:46.403541Z",
"structure_string": "Sn3 Sb1 Se2 I5\n1.0\n7.333296 0.007292 1.124252\n6.070802 4.113715 1.124252\n0.111523 0.034287 12.812195\nSn Sb Se I\n3 1 2 5\ndirect\n0.624431 0.624429 0.477093 Sn\n0.369694 0.369693 0.532041 Sn\n0.639597 0.639596 0.829573 Sn\n0.361574 0.361573 0.186507 Sb\n0.752871 0.752869 0.615928 Se\n0.245955 0.245954 0.381224 Se\n0.720156 0.720154 0.138917 I\n0.289042 0.289043 0.858403 I\n0.972780 0.972777 0.309479 I\n0.025637 0.025638 0.667520 I\n0.998269 0.998266 0.003312 I\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Sn",
"Sb",
"Se",
"I"
],
"chemical_system": "I-Sb-Se-Sn",
"density": 5.4737110175567745,
"density_atomic": 0.028543557174269645,
"volume": 385.37593379972486,
"volume_molar": 21.098073807803498,
"formula_full": "Sn3 Sb1 Se2 I5",
"formula_reduced": "Sn3SbSe2I5",
"formula_anonymous": "AB2C3D5",
"energy_above_hull": 0.4059335734848486,
"spacegroup": 8
},
{
"id": "jvasp-116528",
"created_at": "2022-09-04T14:38:49.439815Z",
"updated_at": "2022-09-04T14:38:49.439844Z",
"structure_string": "Mg16 Al12 Pt1\n1.0\n8.487440 -0.011258 2.934718\n-4.064071 7.451181 2.934718\n0.026939 0.045311 9.007916\nMg Al Pt\n16 12 1\ndirect\n0.992892 0.992891 0.009174 Mg\n0.582253 0.334827 0.017198 Mg\n0.317418 0.999197 0.398605 Mg\n0.353163 0.004397 0.004183 Mg\n0.677848 0.298057 0.309565 Mg\n0.007117 0.603337 0.676909 Mg\n0.603337 0.007117 0.676909 Mg\n0.298057 0.677848 0.309565 Mg\n0.714353 0.408304 0.596206 Mg\n0.999197 0.317418 0.398605 Mg\n0.408305 0.714353 0.596206 Mg\n0.334828 0.582253 0.017198 Mg\n0.610359 0.610359 0.328514 Mg\n0.011099 0.011098 0.650445 Mg\n0.695067 0.695066 0.702376 Mg\n0.004397 0.353163 0.004183 Mg\n0.371146 0.184169 0.632734 Al\n0.002299 0.813153 0.361451 Al\n0.007996 0.633461 0.179058 Al\n0.201195 0.820652 0.811634 Al\n0.820652 0.201195 0.811634 Al\n0.651544 0.836241 0.978114 Al\n0.813153 0.002299 0.361451 Al\n0.184169 0.371146 0.632734 Al\n0.364070 0.364070 0.826752 Al\n0.183902 0.183901 0.191055 Al\n0.836241 0.651544 0.978114 Al\n0.633461 0.007996 0.179058 Al\n0.317565 0.317564 0.360648 Pt\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Mg",
"Al",
"Pt"
],
"chemical_system": "Al-Mg-Pt",
"density": 2.658439291973794,
"density_atomic": 0.051146155645403375,
"volume": 567.0025368291057,
"volume_molar": 11.774376165730892,
"formula_full": "Mg16 Al12 Pt1",
"formula_reduced": "Mg16Al12Pt",
"formula_anonymous": "AB12C16",
"energy_above_hull": 0.4058041310344829,
"spacegroup": 8
},
{
"id": "jvasp-105103",
"created_at": "2022-09-04T14:36:58.707725Z",
"updated_at": "2022-09-04T14:36:58.707742Z",
"structure_string": "Li1 O1\n1.0\n2.511131 -0.000000 0.000000\n0.000000 2.511131 0.000000\n-0.000000 -0.000000 2.511131\nLi O\n1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Li",
"O"
],
"chemical_system": "Li-O",
"density": 2.405702808935003,
"density_atomic": 0.1263053909011224,
"volume": 15.834636872829057,
"volume_molar": 4.767920606583139,
"formula_full": "Li1 O1",
"formula_reduced": "LiO",
"formula_anonymous": "AB",
"energy_above_hull": 0.4057067499999998,
"spacegroup": 221
},
{
"id": "jvasp-98735",
"created_at": "2022-09-04T14:35:57.570350Z",
"updated_at": "2022-09-04T14:35:57.570367Z",
"structure_string": "Ba3 Li4 Sn8\n1.0\n6.379012 0.000000 -2.298975\n-0.341280 6.775691 -0.946956\n-0.035183 -0.025426 9.901850\nBa Li Sn\n3 4 8\ndirect\n0.676951 0.315924 0.353902 Ba\n0.000000 0.000000 0.000000 Ba\n0.323049 0.684075 0.646097 Ba\n0.213026 0.134388 0.426052 Li\n0.786974 0.865612 0.573947 Li\n0.215812 0.500000 -0.000000 Li\n0.784188 0.500000 -0.000001 Li\n0.585911 0.192712 0.696035 Sn\n0.414089 0.807288 0.303964 Sn\n0.110125 0.192712 0.696036 Sn\n0.871599 0.549801 0.743198 Sn\n0.128401 0.450198 0.256801 Sn\n0.516442 0.796747 0.032884 Sn\n0.483558 0.203252 0.967115 Sn\n0.889875 0.807288 0.303963 Sn\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Sn"
],
"chemical_system": "Ba-Li-Sn",
"density": 5.3999993287079775,
"density_atomic": 0.03510756903678466,
"volume": 427.258292486257,
"volume_molar": 17.1533971881966,
"formula_full": "Ba3 Li4 Sn8",
"formula_reduced": "Ba3(LiSn2)4",
"formula_anonymous": "A3B4C8",
"energy_above_hull": 0.405609434,
"spacegroup": 12
},
{
"id": "jvasp-107858",
"created_at": "2022-09-04T14:36:37.010823Z",
"updated_at": "2022-09-04T14:36:37.010848Z",
"structure_string": "K2 Na1 Ta1 Cl6\n1.0\n6.260590 -0.000000 3.614553\n2.086863 5.902541 3.614553\n-0.000000 -0.000000 7.229106\nK Na Ta Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Ta\n0.741213 0.741213 0.258787 Cl\n0.741213 0.258787 0.258787 Cl\n0.258787 0.258787 0.741213 Cl\n0.741213 0.258787 0.741213 Cl\n0.258787 0.741213 0.258787 Cl\n0.258787 0.741213 0.741213 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Ta",
"Cl"
],
"chemical_system": "Cl-K-Na-Ta",
"density": 3.0759960797221253,
"density_atomic": 0.037433560022508756,
"volume": 267.1399672910354,
"volume_molar": 16.08754485648411,
"formula_full": "K2 Na1 Ta1 Cl6",
"formula_reduced": "K2NaTaCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.4055128604999999,
"spacegroup": 225
}
]
}