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=1105",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1103",
"results": [
{
"id": "jvasp-21564",
"created_at": "2022-09-04T14:38:34.850519Z",
"updated_at": "2022-09-04T14:38:34.850553Z",
"structure_string": "Hf4 Si4 Pd4\n1.0\n3.893887 0.000000 0.000000\n-0.000000 6.606275 0.000000\n0.000000 0.000000 7.612732\nHf Si Pd\n4 4 4\ndirect\n0.250000 0.528230 0.679620 Hf\n0.750001 0.471769 0.320379 Hf\n0.250000 0.028230 0.820379 Hf\n0.750001 0.971769 0.179621 Hf\n0.250000 0.257079 0.123917 Si\n0.750001 0.742920 0.876083 Si\n0.250000 0.757079 0.376083 Si\n0.750001 0.242921 0.623917 Si\n0.750001 0.856728 0.562515 Pd\n0.250000 0.143271 0.437485 Pd\n0.750001 0.356728 0.937485 Pd\n0.250000 0.643271 0.062515 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Hf",
"Si",
"Pd"
],
"chemical_system": "Hf-Pd-Si",
"density": 10.616140290156169,
"density_atomic": 0.061277453999167265,
"volume": 195.83059048378666,
"volume_molar": 9.827661508393998,
"formula_full": "Hf4 Si4 Pd4",
"formula_reduced": "HfSiPd",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7460224333333327,
"spacegroup": 62
},
{
"id": "jvasp-59595",
"created_at": "2022-09-04T14:38:33.317050Z",
"updated_at": "2022-09-04T14:38:33.317086Z",
"structure_string": "Li2 V4 O8\n1.0\n5.050340 0.000000 2.915815\n1.683447 4.761506 2.915815\n-0.000000 -0.000000 5.831630\nLi V O\n2 4 8\ndirect\n0.874999 0.875001 0.875001 Li\n0.124999 0.125001 0.124999 Li\n0.500000 0.000000 0.499999 V\n0.999999 0.500000 0.500001 V\n0.499999 0.500000 0.000001 V\n0.499999 0.500000 0.500001 V\n0.259938 0.259938 0.259937 O\n0.259938 0.259938 0.720188 O\n0.740064 0.740063 0.740064 O\n0.740064 0.740063 0.279811 O\n0.279811 0.740063 0.740063 O\n0.259937 0.720190 0.259937 O\n0.720189 0.259938 0.259936 O\n0.740063 0.279811 0.740063 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 4.092815811133212,
"density_atomic": 0.09983277003303292,
"volume": 140.2345141316588,
"volume_molar": 6.0322284536504185,
"formula_full": "Li2 V4 O8",
"formula_reduced": "LiV2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.745918914285714,
"spacegroup": 227
},
{
"id": "jvasp-98470",
"created_at": "2022-09-04T14:35:42.244529Z",
"updated_at": "2022-09-04T14:35:42.244555Z",
"structure_string": "Li12 W6 O24\n1.0\n8.478574 -0.002879 -2.720794\n-3.729773 7.614133 -2.720794\n-0.001796 -0.002879 8.904434\nLi W O\n12 6 24\ndirect\n0.066700 0.297407 0.894373 Li\n0.630411 0.224891 0.390723 Li\n0.390722 0.630410 0.224891 Li\n0.775108 0.609276 0.369590 Li\n0.609277 0.369589 0.775108 Li\n0.224891 0.390723 0.630411 Li\n0.369589 0.775108 0.609277 Li\n0.702592 0.105626 0.933298 Li\n0.933298 0.702593 0.105627 Li\n0.894373 0.066701 0.297406 Li\n0.297406 0.894373 0.066701 Li\n0.105626 0.933298 0.702594 Li\n0.730148 0.966176 0.555595 W\n0.269851 0.033823 0.444404 W\n0.555595 0.730149 0.966178 W\n0.966176 0.555594 0.730149 W\n0.033823 0.444405 0.269851 W\n0.444405 0.269851 0.033823 W\n0.218346 0.182067 0.878758 O\n0.576623 0.248487 0.918680 O\n0.918680 0.576624 0.248488 O\n0.248488 0.918680 0.576624 O\n0.423376 0.751512 0.081321 O\n0.781653 0.817932 0.121243 O\n0.751512 0.081319 0.423376 O\n0.457762 0.140160 0.153383 O\n0.153383 0.457763 0.140160 O\n0.140160 0.153382 0.457763 O\n0.542236 0.859839 0.846617 O\n0.503451 0.811952 0.470940 O\n0.811952 0.470940 0.503451 O\n0.470939 0.503450 0.811952 O\n0.496549 0.188047 0.529060 O\n0.188047 0.529059 0.496548 O\n0.529061 0.496549 0.188048 O\n0.817932 0.121242 0.781653 O\n0.121242 0.781653 0.817933 O\n0.846616 0.542236 0.859840 O\n0.081319 0.423376 0.751513 O\n0.878756 0.218346 0.182067 O\n0.859839 0.846617 0.542237 O\n0.182066 0.878758 0.218347 O\n",
"nsites": 42,
"nelements": 3,
"elements": [
"Li",
"W",
"O"
],
"chemical_system": "Li-O-W",
"density": 4.537949347568518,
"density_atomic": 0.07309241959553764,
"volume": 574.6149906161287,
"volume_molar": 8.239077038800966,
"formula_full": "Li12 W6 O24",
"formula_reduced": "Li2WO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.745902,
"spacegroup": 148
},
{
"id": "jvasp-98464",
"created_at": "2022-09-04T14:36:18.661450Z",
"updated_at": "2022-09-04T14:36:18.661482Z",
"structure_string": "Ta4 Pd6 Se16\n1.0\n3.596523 0.000000 0.000000\n0.000000 10.793212 0.000000\n0.000000 -0.000000 15.385684\nTa Pd Se\n4 6 16\ndirect\n0.500000 0.785500 0.882508 Ta\n0.500000 0.285500 0.617491 Ta\n0.500000 0.714500 0.382508 Ta\n0.500000 0.214500 0.117491 Ta\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n0.000000 0.622251 0.783978 Pd\n0.000000 0.377749 0.216022 Pd\n0.000000 0.122251 0.716021 Pd\n0.000000 0.877749 0.283978 Pd\n0.000000 0.043921 0.156800 Se\n0.000000 0.956079 0.843200 Se\n0.000000 0.730884 0.507753 Se\n0.500000 0.954158 0.384082 Se\n0.000000 0.769115 0.007754 Se\n0.000000 0.456079 0.656800 Se\n0.000000 0.543921 0.343200 Se\n0.500000 0.752300 0.716486 Se\n0.500000 0.247700 0.283513 Se\n0.500000 0.252300 0.783513 Se\n0.500000 0.747700 0.216486 Se\n0.500000 0.545841 0.884082 Se\n0.500000 0.454158 0.115918 Se\n0.500000 0.045842 0.615918 Se\n0.000000 0.230884 -0.007754 Se\n0.000000 0.269115 0.492246 Se\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Ta",
"Pd",
"Se"
],
"chemical_system": "Pd-Se-Ta",
"density": 7.300273534445024,
"density_atomic": 0.04353344037030225,
"volume": 597.2420231169403,
"volume_molar": 13.833367426913032,
"formula_full": "Ta4 Pd6 Se16",
"formula_reduced": "Ta2Pd3Se8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.745681725641025,
"spacegroup": 55
},
{
"id": "jvasp-80057",
"created_at": "2022-09-04T14:37:16.164139Z",
"updated_at": "2022-09-04T14:37:16.164162Z",
"structure_string": "Ti1 Fe2 Ge1\n1.0\n0.000009 2.890205 2.890205\n2.890203 0.000009 2.890205\n2.890204 2.890205 0.000009\nTi Fe Ge\n1 2 1\ndirect\n0.749999 0.749998 0.750000 Ti\n0.999999 0.999997 1.000000 Fe\n0.500001 0.499999 0.500001 Fe\n0.250000 0.249999 0.250001 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Ti",
"density": 7.985314327612329,
"density_atomic": 0.0828411855628533,
"volume": 48.2851612132605,
"volume_molar": 7.269500936138678,
"formula_full": "Ti1 Fe2 Ge1",
"formula_reduced": "TiFe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.745613820833333,
"spacegroup": 225
},
{
"id": "jvasp-111972",
"created_at": "2022-09-04T14:38:28.445397Z",
"updated_at": "2022-09-04T14:38:28.445424Z",
"structure_string": "Li4 Mn2 P4 O16\n1.0\n9.904947 0.026929 0.125222\n0.008564 5.680759 0.164063\n-0.013456 0.017880 4.677858\nLi Mn P O\n4 2 4 16\ndirect\n-0.000000 -0.000000 0.000000 Li\n0.230582 0.750042 0.465294 Li\n0.500000 0.500000 0.500000 Li\n0.769417 0.249958 0.534706 Li\n0.278774 0.255304 0.988553 Mn\n0.721225 0.744697 0.011446 Mn\n0.898462 0.745662 0.587349 P\n0.588814 0.242540 0.067171 P\n0.101537 0.254338 0.412650 P\n0.411185 0.757461 0.932828 P\n0.559327 0.748681 0.802202 O\n0.822711 0.952697 0.750604 O\n0.816557 0.542717 0.746440 O\n0.659710 0.458673 0.214059 O\n0.661110 0.020756 0.202984 O\n0.591751 0.258331 0.748076 O\n0.440672 0.251320 0.197798 O\n0.177289 0.047303 0.249396 O\n0.340290 0.541327 0.785940 O\n0.338889 0.979244 0.797015 O\n0.183443 0.457283 0.253560 O\n0.876605 0.753444 0.259983 O\n0.123394 0.246556 0.740017 O\n0.045797 0.756525 0.658736 O\n0.408249 0.741669 0.251924 O\n0.954203 0.243476 0.341264 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.265196503789401,
"density_atomic": 0.09878745288189972,
"volume": 263.19131875060054,
"volume_molar": 6.096058339715937,
"formula_full": "Li4 Mn2 P4 O16",
"formula_reduced": "Li2Mn(PO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 2.7455050954907163,
"spacegroup": 2
},
{
"id": "jvasp-75660",
"created_at": "2022-09-04T14:35:50.239070Z",
"updated_at": "2022-09-04T14:35:50.239088Z",
"structure_string": "Co1 As1 Pt2\n1.0\n0.000000 3.118888 3.118888\n3.118888 0.000000 3.118888\n3.118888 3.118888 0.000000\nCo As Pt\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Co\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Pt\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Co",
"As",
"Pt"
],
"chemical_system": "As-Co-Pt",
"density": 14.340686529771645,
"density_atomic": 0.0659220428814861,
"volume": 60.67773122855361,
"volume_molar": 9.13524596139494,
"formula_full": "Co1 As1 Pt2",
"formula_reduced": "CoAsPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.745503862500001,
"spacegroup": 216
},
{
"id": "jvasp-20304",
"created_at": "2022-09-04T14:37:58.177661Z",
"updated_at": "2022-09-04T14:37:58.177672Z",
"structure_string": "Er3 Co9\n1.0\n4.557108 -0.081636 7.136412\n2.022965 4.084299 7.136412\n-0.134203 -0.081636 8.466262\nEr Co\n3 9\ndirect\n0.860743 0.860739 0.860739 Er\n0.139260 0.139260 0.139260 Er\n0.000000 0.000000 0.000000 Er\n0.916907 0.421094 0.421095 Co\n0.332458 0.332457 0.332457 Co\n0.667544 0.667541 0.667541 Co\n0.578906 0.578904 0.083094 Co\n0.083096 0.578904 0.578904 Co\n0.421097 0.421094 0.916905 Co\n0.578906 0.083093 0.578904 Co\n0.421097 0.916905 0.421094 Co\n0.500001 0.499999 0.499999 Co\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Er",
"Co"
],
"chemical_system": "Co-Er",
"density": 10.422842599059885,
"density_atomic": 0.07297341558566732,
"volume": 164.44344702369824,
"volume_molar": 8.252513208635948,
"formula_full": "Er3 Co9",
"formula_reduced": "ErCo3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.745390675,
"spacegroup": 166
},
{
"id": "jvasp-46708",
"created_at": "2022-09-04T14:38:34.569162Z",
"updated_at": "2022-09-04T14:38:34.569189Z",
"structure_string": "Li4 Al2 P2 C2 O14\n1.0\n0.000000 4.960440 0.020182\n6.173523 0.000000 0.000000\n0.000000 -0.574446 -8.294322\nLi Al P C O\n4 2 2 2 14\ndirect\n0.776467 0.015455 0.210286 Li\n0.776467 0.484545 0.210286 Li\n0.223532 0.515455 0.789714 Li\n0.223532 0.984544 0.789714 Li\n0.208450 0.250000 0.345846 Al\n0.791549 0.750000 0.654154 Al\n0.272784 0.750000 0.423470 P\n0.727215 0.250000 0.576530 P\n0.266992 0.250000 0.060036 C\n0.733007 0.750000 0.939964 C\n0.535096 0.750000 0.823971 O\n0.818210 0.050391 0.675428 O\n0.818210 0.449609 0.675428 O\n0.143718 0.750000 0.588065 O\n0.415771 0.250000 0.539053 O\n0.584228 0.750000 0.460947 O\n0.028036 0.250000 0.116776 O\n0.181789 0.550390 0.324572 O\n0.181789 0.949609 0.324572 O\n0.464903 0.250000 0.176030 O\n0.971963 0.750000 0.883224 O\n0.691932 0.750000 0.088000 O\n0.856281 0.250000 0.411935 O\n0.308067 0.250000 0.912000 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"Al",
"P",
"C",
"O"
],
"chemical_system": "Al-C-Li-O-P",
"density": 2.5613985082451856,
"density_atomic": 0.0945147243906404,
"volume": 253.92868841055065,
"volume_molar": 6.371642935877153,
"formula_full": "Li4 Al2 P2 C2 O14",
"formula_reduced": "Li2AlPCO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.745332733333333,
"spacegroup": 11
},
{
"id": "jvasp-26856",
"created_at": "2022-09-04T14:38:32.000754Z",
"updated_at": "2022-09-04T14:38:32.000784Z",
"structure_string": "Ce2 P4 Rh4\n1.0\n4.181216 -0.000000 0.000000\n-0.000000 4.181216 -0.000000\n0.000000 -0.000000 9.494698\nCe P Rh\n2 4 4\ndirect\n0.000000 0.500000 0.744457 Ce\n0.500000 0.000000 0.255543 Ce\n0.000000 0.500000 0.138255 P\n0.500000 0.000000 0.861746 P\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.000000 0.500000 0.386932 Rh\n0.500000 0.000000 0.613068 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"P",
"Rh"
],
"chemical_system": "Ce-P-Rh",
"density": 8.160547749017958,
"density_atomic": 0.06024397743492113,
"volume": 165.99169619573263,
"volume_molar": 9.996253594818585,
"formula_full": "Ce2 P4 Rh4",
"formula_reduced": "Ce(PRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7451945,
"spacegroup": 129
},
{
"id": "jvasp-7958",
"created_at": "2022-09-04T14:36:36.450504Z",
"updated_at": "2022-09-04T14:36:36.450536Z",
"structure_string": "Mn3 As3 Rh3\n1.0\n3.194958 -5.533830 -0.000000\n3.194958 5.533830 -0.000000\n-0.000000 0.000000 3.658446\nMn As Rh\n3 3 3\ndirect\n0.739248 0.739248 0.000000 Mn\n0.260752 0.000000 0.000000 Mn\n0.000000 0.260752 0.000000 Mn\n0.000000 0.000000 0.500001 As\n0.333333 0.666667 0.000000 As\n0.666667 0.333333 0.000000 As\n0.000000 0.614037 0.500001 Rh\n0.385963 0.385963 0.500001 Rh\n0.614037 0.000000 0.500001 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"As",
"Rh"
],
"chemical_system": "As-Mn-Rh",
"density": 8.963356888376316,
"density_atomic": 0.06957046367389537,
"volume": 129.36524387973904,
"volume_molar": 8.656174534394633,
"formula_full": "Mn3 As3 Rh3",
"formula_reduced": "MnAsRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7451573304597696,
"spacegroup": 189
},
{
"id": "jvasp-119146",
"created_at": "2022-09-04T14:38:51.257469Z",
"updated_at": "2022-09-04T14:38:51.257493Z",
"structure_string": "Sr1 Ca3 Ru4 O12\n1.0\n7.745808 -0.000000 0.000000\n0.000000 5.417084 0.005988\n-0.000000 -0.001742 5.584058\nSr Ca Ru O\n1 3 4 12\ndirect\n0.500000 0.490796 0.546630 Sr\n0.500000 0.015520 0.054993 Ca\n-0.000000 0.513331 0.440360 Ca\n-0.000000 0.986010 0.945001 Ca\n0.247139 0.000552 0.500322 Ru\n0.752446 0.499273 0.999415 Ru\n0.752862 0.000552 0.500322 Ru\n0.247554 0.499273 0.999415 Ru\n0.500000 0.930506 0.471120 O\n0.500000 0.594629 0.991110 O\n0.285894 0.294866 0.290662 O\n0.704945 0.193702 0.801990 O\n0.798929 0.697581 0.701983 O\n0.714106 0.294866 0.290662 O\n0.201071 0.697581 0.701983 O\n0.801595 0.798851 0.204055 O\n-0.000000 0.404137 0.022123 O\n0.295055 0.193702 0.801990 O\n0.198405 0.798851 0.204055 O\n-0.000000 0.095415 0.531817 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ru",
"O"
],
"chemical_system": "Ca-O-Ru-Sr",
"density": 5.698903013798354,
"density_atomic": 0.08535866765923492,
"volume": 234.30543784777794,
"volume_molar": 7.055101637763751,
"formula_full": "Sr1 Ca3 Ru4 O12",
"formula_reduced": "SrCa3(RuO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.7450200785,
"spacegroup": 6
}
]
}