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=nsites&page=3467",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3465",
"results": [
{
"id": "jvasp-10738",
"created_at": "2022-09-04T14:38:12.962015Z",
"updated_at": "2022-09-04T14:38:12.962037Z",
"structure_string": "Zn1 Bi4 O8\n1.0\n3.629327 -0.149873 -0.161309\n-1.733469 6.801101 -0.697710\n-1.742023 -2.604530 8.406671\nZn Bi O\n1 4 8\ndirect\n0.573914 0.256942 0.759531 Zn\n0.321680 0.732082 0.941977 Bi\n0.206891 0.088550 0.347006 Bi\n0.705735 0.790145 0.589402 Bi\n0.796633 0.444852 0.182407 Bi\n0.369423 0.430858 0.340497 O\n0.402130 0.944837 0.805139 O\n0.617593 0.076653 0.184336 O\n0.653070 0.565579 0.767590 O\n0.916780 0.770719 0.106332 O\n0.935304 0.139094 0.619534 O\n0.128053 0.420013 0.965231 O\n0.100929 0.770325 0.414911 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Bi",
"O"
],
"chemical_system": "Bi-O-Zn",
"density": 8.724841044400574,
"density_atomic": 0.06635886049393892,
"volume": 195.90450925822321,
"volume_molar": 9.075111771321104,
"formula_full": "Zn1 Bi4 O8",
"formula_reduced": "Zn(BiO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.922124276923077,
"spacegroup": 1
},
{
"id": "jvasp-10739",
"created_at": "2022-09-04T14:38:11.837691Z",
"updated_at": "2022-09-04T14:38:11.837717Z",
"structure_string": "Mg1 Bi4 O8\n1.0\n3.447865 -0.000243 -0.000163\n-1.723441 6.691006 -0.284412\n-1.723477 -1.884552 9.180529\nMg Bi O\n1 4 8\ndirect\n0.497591 0.201995 0.793044 Mg\n0.263186 0.641533 0.884719 Bi\n0.327790 0.207292 0.448161 Bi\n0.678699 0.797458 0.559805 Bi\n0.801214 0.428691 0.173612 Bi\n0.422824 0.526109 0.319421 O\n0.329865 0.885126 0.774469 O\n0.727235 0.165443 0.288887 O\n0.620090 0.497527 0.742518 O\n0.883181 0.731463 0.034797 O\n0.886229 0.133221 0.639109 O\n0.139021 0.340031 0.937876 O\n0.151195 0.874766 0.427478 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mg",
"Bi",
"O"
],
"chemical_system": "Bi-Mg-O",
"density": 7.816520222144287,
"density_atomic": 0.061923184209889376,
"volume": 209.93752446476822,
"volume_molar": 9.725179408713677,
"formula_full": "Mg1 Bi4 O8",
"formula_reduced": "Mg(BiO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.976349557692308,
"spacegroup": 8
},
{
"id": "jvasp-58246",
"created_at": "2022-09-04T14:37:57.073461Z",
"updated_at": "2022-09-04T14:37:57.073489Z",
"structure_string": "Zr1 Co6 Ge6\n1.0\n2.543249 -4.405037 0.000000\n2.543249 4.405037 -0.000000\n0.000000 0.000000 7.753796\nZr Co Ge\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.749940 Co\n-0.000000 0.500000 0.250060 Co\n0.500000 -0.000000 0.250060 Co\n0.500000 0.500000 0.250060 Co\n-0.000000 0.500000 0.749940 Co\n0.500000 -0.000000 0.749940 Co\n0.666667 0.333333 0.500000 Ge\n0.000000 0.000000 0.339355 Ge\n0.000000 0.000000 0.660645 Ge\n0.333333 0.666667 0.000000 Ge\n0.666667 0.333333 0.000000 Ge\n0.333333 0.666667 0.500000 Ge\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Zr",
"density": 8.41736427387754,
"density_atomic": 0.07482738065894626,
"volume": 173.73319613113756,
"volume_molar": 8.04804432143383,
"formula_full": "Zr1 Co6 Ge6",
"formula_reduced": "Zr(CoGe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 2.7020573538461536,
"spacegroup": 191
},
{
"id": "jvasp-9235",
"created_at": "2022-09-04T14:37:57.525862Z",
"updated_at": "2022-09-04T14:37:57.525885Z",
"structure_string": "Sr2 Y1 Tl1 Sn2 O7\n1.0\n4.181118 0.000000 0.000000\n0.000000 4.181118 -0.000000\n0.000000 -0.000000 12.555567\nSr Y Tl Sn O\n2 1 1 2 7\ndirect\n0.500000 0.500000 0.184035 Sr\n0.500000 0.500000 0.815965 Sr\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Tl\n0.000000 0.000000 0.369538 Sn\n0.000000 0.000000 0.630462 Sn\n0.000000 0.500000 0.386681 O\n0.500000 0.000000 0.386681 O\n0.000000 0.500000 0.613320 O\n0.500000 0.000000 0.613320 O\n0.000000 0.000000 0.208117 O\n0.000000 0.000000 0.791883 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 13,
"nelements": 5,
"elements": [
"Sr",
"Y",
"Tl",
"Sn",
"O"
],
"chemical_system": "O-Sn-Sr-Tl-Y",
"density": 6.188024066712228,
"density_atomic": 0.05922733254793336,
"volume": 219.49325490015866,
"volume_molar": 10.167840591379345,
"formula_full": "Sr2 Y1 Tl1 Sn2 O7",
"formula_reduced": "Sr2YTlSn2O7",
"formula_anonymous": "ABC2D2E7",
"energy_above_hull": 1.6170952746153846,
"spacegroup": 123
},
{
"id": "jvasp-12359",
"created_at": "2022-09-04T14:37:45.294988Z",
"updated_at": "2022-09-04T14:37:45.295011Z",
"structure_string": "K2 Pb1 S2 O8\n1.0\n5.169288 0.023946 5.586138\n2.204003 4.675948 5.586138\n0.037567 0.023946 7.610852\nK Pb S O\n2 1 2 8\ndirect\n0.798793 0.798796 0.798793 K\n0.201206 0.201207 0.201206 K\n0.000000 0.000000 0.000000 Pb\n0.597489 0.597491 0.597489 S\n0.402510 0.402511 0.402510 S\n0.719951 0.719953 0.278890 O\n0.719951 0.278892 0.719951 O\n0.278890 0.719953 0.719951 O\n0.721109 0.280050 0.280048 O\n0.280048 0.280050 0.721109 O\n0.331234 0.331235 0.331234 O\n0.668765 0.668767 0.668765 O\n0.280048 0.721110 0.280049 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"K",
"Pb",
"S",
"O"
],
"chemical_system": "K-O-Pb-S",
"density": 4.352294680897387,
"density_atomic": 0.07135416763872834,
"volume": 182.18977853991657,
"volume_molar": 8.439788395389268,
"formula_full": "K2 Pb1 S2 O8",
"formula_reduced": "K2Pb(SO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 1.8894942169230768,
"spacegroup": 166
},
{
"id": "jvasp-21021",
"created_at": "2022-09-04T14:37:45.370785Z",
"updated_at": "2022-09-04T14:37:45.370807Z",
"structure_string": "Th1 Al8 Fe4\n1.0\n4.685320 0.000000 1.912297\n2.342660 6.223080 0.956148\n-0.008940 0.000000 6.717805\nTh Al Fe\n1 8 4\ndirect\n0.000000 0.000000 0.000000 Th\n0.724413 0.775587 0.775588 Al\n0.500000 0.224413 0.775588 Al\n0.500000 0.775587 0.224414 Al\n0.275587 0.224413 0.224413 Al\n0.654694 0.345306 0.345307 Al\n0.345306 0.654694 0.654695 Al\n-0.000000 0.345306 0.654694 Al\n-0.000000 0.654694 0.345307 Al\n0.000000 -0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 -0.000000 0.500001 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Th",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-Th",
"density": 5.687726605245196,
"density_atomic": 0.06633389372232706,
"volume": 195.9782438585296,
"volume_molar": 9.078527464720544,
"formula_full": "Th1 Al8 Fe4",
"formula_reduced": "Th(Al2Fe)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.8625184615384613,
"spacegroup": 139
},
{
"id": "jvasp-38510",
"created_at": "2022-09-04T14:37:45.498110Z",
"updated_at": "2022-09-04T14:37:45.498126Z",
"structure_string": "Pr1 Al8 Fe4\n1.0\n-0.000000 -0.000000 -5.062447\n4.399683 4.399683 2.531225\n4.399683 -4.399683 -2.531225\nPr Al Fe\n1 8 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.225070 0.225070 Al\n0.274929 0.774929 0.225071 Al\n-0.000000 0.342348 0.342348 Al\n0.657653 0.657653 0.342348 Al\n0.342347 0.342348 0.657653 Al\n0.000000 0.657653 0.657653 Al\n0.725072 0.225071 0.774929 Al\n0.500000 0.774929 0.774929 Al\n0.000001 0.500000 0.000000 Fe\n0.500001 0.500000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.499999 0.000000 0.500000 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Pr",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-Pr",
"density": 4.915284036838038,
"density_atomic": 0.0663300148151831,
"volume": 195.98970445313802,
"volume_molar": 9.079058367135355,
"formula_full": "Pr1 Al8 Fe4",
"formula_reduced": "Pr(Al2Fe)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.703525711538462,
"spacegroup": 139
},
{
"id": "jvasp-59674",
"created_at": "2022-09-04T14:37:49.847268Z",
"updated_at": "2022-09-04T14:37:49.847283Z",
"structure_string": "Ba2 Y1 Cu3 O7\n1.0\n3.839774 -0.000000 0.000000\n-0.000000 3.923790 0.000000\n0.000000 0.000000 11.718929\nBa Y Cu O\n2 1 3 7\ndirect\n0.500000 0.500000 0.817903 Ba\n0.500000 0.500000 0.182098 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.646157 Cu\n0.000000 0.000000 0.353844 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.620529 O\n0.500000 0.000000 0.379471 O\n0.000000 0.500000 0.621741 O\n0.000000 0.500000 0.378259 O\n0.000000 0.000000 0.839549 O\n0.000000 0.000000 0.160451 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Cu",
"O"
],
"chemical_system": "Ba-Cu-O-Y",
"density": 6.265420786495173,
"density_atomic": 0.07362817055209973,
"volume": 176.56285498498326,
"volume_molar": 8.17912589005413,
"formula_full": "Ba2 Y1 Cu3 O7",
"formula_reduced": "Ba2YCu3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 1.5465010184615384,
"spacegroup": 47
},
{
"id": "jvasp-23734",
"created_at": "2022-09-04T14:37:39.399045Z",
"updated_at": "2022-09-04T14:37:39.399056Z",
"structure_string": "Zr1 Mn6 Ge6\n1.0\n2.521494 -4.367356 0.000000\n2.521494 4.367356 0.000000\n-0.000000 -0.000000 8.062989\nZr Mn Ge\n1 6 6\ndirect\n0.000000 0.000000 0.500000 Zr\n0.500000 -0.000001 0.251174 Mn\n0.499999 0.499999 0.251174 Mn\n-0.000001 0.500000 0.251174 Mn\n0.500000 -0.000001 0.748827 Mn\n0.499999 0.499999 0.748827 Mn\n-0.000001 0.500000 0.748827 Mn\n0.000000 0.000000 0.158044 Ge\n0.000000 0.000000 0.841956 Ge\n0.333332 0.666666 0.500000 Ge\n0.666666 0.333332 0.500000 Ge\n0.333332 0.666666 0.000000 Ge\n0.666666 0.333332 0.000000 Ge\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zr",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Zr",
"density": 8.01071626014968,
"density_atomic": 0.0732050018390238,
"volume": 177.583493933744,
"volume_molar": 8.226406131704712,
"formula_full": "Zr1 Mn6 Ge6",
"formula_reduced": "Zr(MnGe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 3.2558956652519893,
"spacegroup": 191
},
{
"id": "jvasp-26131",
"created_at": "2022-09-04T14:37:39.433581Z",
"updated_at": "2022-09-04T14:37:39.433609Z",
"structure_string": "Ba3 Nb2 O8\n1.0\n5.656122 0.013032 5.693233\n2.355726 5.142222 5.693233\n0.020253 0.013032 8.025223\nBa Nb O\n3 2 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.800285 0.800284 0.800285 Ba\n0.199715 0.199715 0.199715 Ba\n0.405952 0.405952 0.405952 Nb\n0.594048 0.594047 0.594048 Nb\n0.267186 0.267185 0.770896 O\n0.770896 0.267185 0.267186 O\n0.267186 0.770895 0.267185 O\n0.732814 0.732814 0.229104 O\n0.229105 0.732814 0.732814 O\n0.732814 0.229104 0.732814 O\n0.319588 0.319588 0.319588 O\n0.680412 0.680411 0.680411 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ba",
"Nb",
"O"
],
"chemical_system": "Ba-Nb-O",
"density": 5.18742546018862,
"density_atomic": 0.05595459623452678,
"volume": 232.33122700970094,
"volume_molar": 10.76254886150718,
"formula_full": "Ba3 Nb2 O8",
"formula_reduced": "Ba3Nb2O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.5576688238461536,
"spacegroup": 166
},
{
"id": "jvasp-57724",
"created_at": "2022-09-04T14:37:57.419953Z",
"updated_at": "2022-09-04T14:37:57.419986Z",
"structure_string": "Ca3 P2 O8\n1.0\n4.869789 -0.006378 4.932160\n2.020479 4.430864 4.932160\n-0.009932 -0.006378 6.931158\nCa P O\n3 2 8\ndirect\n0.000000 0.000000 0.000000 Ca\n0.202655 0.202655 0.202655 Ca\n0.797346 0.797343 0.797345 Ca\n0.404979 0.404978 0.404979 P\n0.595022 0.595021 0.595022 P\n0.727440 0.727438 0.246175 O\n0.727440 0.246174 0.727439 O\n0.246175 0.727438 0.727439 O\n0.753826 0.272561 0.272561 O\n0.272562 0.272561 0.753826 O\n0.322900 0.322899 0.322899 O\n0.677102 0.677100 0.677101 O\n0.272562 0.753825 0.272561 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ca",
"P",
"O"
],
"chemical_system": "Ca-O-P",
"density": 3.4348249417959758,
"density_atomic": 0.08669412305864448,
"volume": 149.9524943715748,
"volume_molar": 6.946423295528701,
"formula_full": "Ca3 P2 O8",
"formula_reduced": "Ca3(PO4)2",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.0255415584615384,
"spacegroup": 166
},
{
"id": "jvasp-23808",
"created_at": "2022-09-04T14:37:39.071200Z",
"updated_at": "2022-09-04T14:37:39.071227Z",
"structure_string": "Er1 Mn12\n1.0\n4.242114 0.000000 1.664899\n2.121057 5.827723 0.832449\n-0.008040 0.000000 6.257328\nEr Mn\n1 12\ndirect\n0.000000 0.000000 0.000000 Er\n0.725061 0.774939 0.774940 Mn\n0.499999 -0.000000 0.500000 Mn\n0.000001 0.500000 -0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n-0.000000 -0.000000 0.500000 Mn\n0.364444 0.635556 0.635556 Mn\n0.000000 0.364444 0.635556 Mn\n0.000001 0.635556 0.364444 Mn\n0.635556 0.364444 0.364444 Mn\n0.274939 0.225061 0.225061 Mn\n0.500000 0.774939 0.225061 Mn\n0.500000 0.225061 0.774939 Mn\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Er",
"Mn"
],
"chemical_system": "Er-Mn",
"density": 8.867700419442825,
"density_atomic": 0.08399515659488464,
"volume": 154.77082878361713,
"volume_molar": 7.169628588283091,
"formula_full": "Er1 Mn12",
"formula_reduced": "ErMn12",
"formula_anonymous": "AB12",
"energy_above_hull": 4.933388222811671,
"spacegroup": 139
}
]
}