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=-formula_anonymous&page=4545",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=4543",
"results": [
{
"id": "jvasp-37270",
"created_at": "2022-09-04T14:38:00.706934Z",
"updated_at": "2022-09-04T14:38:00.706959Z",
"structure_string": "Sm2 Au2 O5\n1.0\n4.194027 -0.000000 0.000000\n0.000000 4.194027 0.000000\n0.000000 -0.000000 7.085753\nSm Au O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.500000 Sm\n0.500000 0.500000 0.191844 Au\n0.500000 0.500000 0.808155 Au\n0.500000 0.000000 0.226436 O\n0.500000 0.000000 0.773564 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.226436 O\n0.000000 0.500000 0.773564 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sm",
"Au",
"O"
],
"chemical_system": "Au-O-Sm",
"density": 10.320630904381407,
"density_atomic": 0.07220945315793967,
"volume": 124.63742081406997,
"volume_molar": 8.339823245618701,
"formula_full": "Sm2 Au2 O5",
"formula_reduced": "Sm2Au2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.9248355988888888,
"spacegroup": 123
},
{
"id": "jvasp-41948",
"created_at": "2022-09-04T14:37:43.044135Z",
"updated_at": "2022-09-04T14:37:43.044156Z",
"structure_string": "Rb2 Zr2 O5\n1.0\n4.095088 0.000000 -0.000000\n0.000000 4.095088 0.000000\n0.000000 -0.000000 9.059188\nRb Zr O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.500000 0.500000 0.276405 Zr\n0.500000 0.500000 0.723596 Zr\n0.500000 0.000000 0.231470 O\n0.500000 0.000000 0.768531 O\n0.000000 0.500000 0.231470 O\n0.000000 0.500000 0.768531 O\n0.500000 0.500000 0.500000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Zr",
"O"
],
"chemical_system": "O-Rb-Zr",
"density": 4.736993774055249,
"density_atomic": 0.05924159726304396,
"volume": 151.92027925982967,
"volume_molar": 10.165392288902256,
"formula_full": "Rb2 Zr2 O5",
"formula_reduced": "Rb2Zr2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.1467185,
"spacegroup": 123
},
{
"id": "jvasp-50462",
"created_at": "2022-09-04T14:37:38.115177Z",
"updated_at": "2022-09-04T14:37:38.115201Z",
"structure_string": "Li4 Zr4 O10\n1.0\n4.487152 3.267030 0.967316\n-4.487152 3.267030 -0.967316\n1.564479 0.000000 7.454693\nLi Zr O\n4 4 10\ndirect\n0.785294 0.814472 0.455218 Li\n0.185528 0.214706 -0.044781 Li\n0.814472 0.785294 0.044781 Li\n0.214706 0.185528 0.544781 Li\n0.221343 0.718846 0.621678 Zr\n0.281154 0.778657 0.121679 Zr\n0.718846 0.221343 0.878321 Zr\n0.778657 0.281154 0.378321 Zr\n0.365247 0.926375 0.871150 O\n0.500000 0.500000 0.000000 O\n0.023591 0.023591 0.250000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.634753 0.073625 0.128850 O\n0.926375 0.365247 0.628849 O\n0.073625 0.634753 0.371150 O\n0.976409 0.976409 0.750000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Zr",
"O"
],
"chemical_system": "Li-O-Zr",
"density": 4.3976964223198225,
"density_atomic": 0.08625719598772279,
"volume": 208.67824178474322,
"volume_molar": 6.9816096976502084,
"formula_full": "Li4 Zr4 O10",
"formula_reduced": "Li2Zr2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.5533851666666667,
"spacegroup": 15
},
{
"id": "jvasp-109022",
"created_at": "2022-09-04T14:37:47.512799Z",
"updated_at": "2022-09-04T14:37:47.512818Z",
"structure_string": "Ba2 Tc2 O5\n1.0\n3.962848 -0.000000 0.000000\n0.000000 3.962848 0.000000\n-0.000000 -0.000000 8.398183\nBa Tc O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.242284 Tc\n0.500000 0.500000 0.757716 Tc\n0.500000 0.000000 0.237229 O\n0.500000 0.000000 0.762771 O\n-0.000000 0.500000 0.237229 O\n-0.000000 0.500000 0.762771 O\n0.500000 0.500000 0.500000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Tc",
"O"
],
"chemical_system": "Ba-O-Tc",
"density": 6.933066508194236,
"density_atomic": 0.06824052291323243,
"volume": 131.88644541079302,
"volume_molar": 8.824874873331686,
"formula_full": "Ba2 Tc2 O5",
"formula_reduced": "Ba2Tc2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.724450271111111,
"spacegroup": 123
},
{
"id": "jvasp-110483",
"created_at": "2022-09-04T14:38:39.201050Z",
"updated_at": "2022-09-04T14:38:39.201067Z",
"structure_string": "Yb2 Al2 O5\n1.0\n3.664332 0.000000 0.000000\n0.000000 3.664332 0.000000\n0.000000 0.000000 7.178431\nYb Al O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Yb\n0.000000 0.000000 0.500000 Yb\n0.500000 0.500000 0.253837 Al\n0.500000 0.500000 0.746163 Al\n0.500000 0.000000 0.211253 O\n0.500000 0.000000 0.788747 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.211253 O\n0.000000 0.500000 0.788747 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Yb",
"Al",
"O"
],
"chemical_system": "Al-O-Yb",
"density": 8.270036640238924,
"density_atomic": 0.09337343777841248,
"volume": 96.38715478547755,
"volume_molar": 6.4495223730450375,
"formula_full": "Yb2 Al2 O5",
"formula_reduced": "Yb2Al2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.4418838333333333,
"spacegroup": 123
},
{
"id": "jvasp-37424",
"created_at": "2022-09-04T14:35:56.311583Z",
"updated_at": "2022-09-04T14:35:56.311609Z",
"structure_string": "Ta2 Be2 O5\n1.0\n3.532678 -0.000000 -0.000000\n0.000000 3.532678 -0.000000\n0.000000 0.000000 6.381108\nTa Be O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.500000 0.500000 0.747477 Be\n0.500000 0.500000 0.252524 Be\n0.000000 0.500000 0.796903 O\n0.000000 0.500000 0.203097 O\n0.500000 0.500000 0.500000 O\n0.500000 0.000000 0.796903 O\n0.500000 0.000000 0.203097 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ta",
"Be",
"O"
],
"chemical_system": "Be-O-Ta",
"density": 9.590129567693706,
"density_atomic": 0.11301557705192755,
"volume": 79.6350400074916,
"volume_molar": 5.328593559481621,
"formula_full": "Ta2 Be2 O5",
"formula_reduced": "Ta2Be2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 3.628829788888889,
"spacegroup": 123
},
{
"id": "jvasp-90535",
"created_at": "2022-09-04T14:35:54.747030Z",
"updated_at": "2022-09-04T14:35:54.747040Z",
"structure_string": "Ba2 Sc2 O5\n1.0\n8.268614 0.000000 0.000000\n-0.000000 4.168812 0.000000\n0.000000 0.000000 4.168812\nBa Sc O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.000000 0.000000 Ba\n0.261116 0.500000 0.500000 Sc\n0.738883 0.500000 0.500000 Sc\n0.221459 0.500000 0.000000 O\n0.778541 0.500000 0.000000 O\n0.221459 0.000000 0.500000 O\n0.778541 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"O"
],
"chemical_system": "Ba-O-Sc",
"density": 5.137181394960763,
"density_atomic": 0.06263039784162919,
"volume": 143.70018888843586,
"volume_molar": 9.615364052497208,
"formula_full": "Ba2 Sc2 O5",
"formula_reduced": "Ba2Sc2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.83079666,
"spacegroup": 123
},
{
"id": "jvasp-85960",
"created_at": "2022-09-04T14:35:52.322761Z",
"updated_at": "2022-09-04T14:35:52.322789Z",
"structure_string": "La4 Pd4 O10\n1.0\n5.653002 0.000000 0.000000\n0.000000 6.724680 -0.000000\n0.000000 0.000000 6.724680\nLa Pd O\n4 4 10\ndirect\n0.500000 0.107271 0.737076 La\n0.000000 0.737076 0.892729 La\n0.500000 0.892729 0.262924 La\n0.000000 0.262924 0.107271 La\n0.000000 0.309003 0.595305 Pd\n0.500000 0.404695 0.309003 Pd\n0.000000 0.690997 0.404695 Pd\n0.500000 0.595305 0.690997 Pd\n0.742092 0.800242 0.594621 O\n0.242092 0.594621 0.199758 O\n0.757908 0.594621 0.199758 O\n0.750000 0.000000 0.000000 O\n0.257908 0.800242 0.594621 O\n0.742092 0.199758 0.405379 O\n0.757908 0.405379 0.800242 O\n0.250000 0.000000 0.000000 O\n0.257908 0.199758 0.405379 O\n0.242092 0.405379 0.800242 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"La",
"Pd",
"O"
],
"chemical_system": "La-O-Pd",
"density": 7.413528510993978,
"density_atomic": 0.07041255772029364,
"volume": 255.6362186345094,
"volume_molar": 8.552651622061946,
"formula_full": "La4 Pd4 O10",
"formula_reduced": "La2Pd2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.2507865444444444,
"spacegroup": 84
},
{
"id": "jvasp-12433",
"created_at": "2022-09-04T14:37:10.033349Z",
"updated_at": "2022-09-04T14:37:10.033369Z",
"structure_string": "Sr4 In4 O10\n1.0\n5.563491 -0.000000 -1.906372\n-0.707185 5.712839 -2.063827\n-0.017135 -0.016045 9.021332\nSr In O\n4 4 10\ndirect\n0.123373 0.631518 0.214828 Sr\n0.908545 0.368483 0.785172 Sr\n0.623373 0.083311 0.214829 Sr\n0.408544 0.916690 0.785171 Sr\n0.291416 0.311811 0.500000 In\n0.501859 0.500000 -0.000000 In\n0.001860 0.000000 0.000000 In\n0.791415 0.688190 0.500000 In\n0.738388 0.725454 0.964336 O\n0.650605 0.367035 0.500000 O\n0.238388 0.738884 0.964336 O\n0.814104 0.943424 0.722445 O\n0.091660 0.056577 0.277555 O\n0.314105 0.279022 0.722445 O\n0.591659 0.720979 0.277555 O\n0.150605 0.632966 0.500000 O\n0.274052 0.261117 0.035664 O\n0.774051 0.274547 0.035664 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sr",
"In",
"O"
],
"chemical_system": "In-O-Sr",
"density": 5.6238266570618265,
"density_atomic": 0.06286332333483902,
"volume": 286.335482203569,
"volume_molar": 9.579736546735374,
"formula_full": "Sr4 In4 O10",
"formula_reduced": "Sr2In2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.0505977844444443,
"spacegroup": 46
},
{
"id": "jvasp-9565",
"created_at": "2022-09-04T14:37:14.703263Z",
"updated_at": "2022-09-04T14:37:14.703292Z",
"structure_string": "Zn4 Sb4 O10\n1.0\n3.326077 0.003792 0.313476\n-0.005070 9.429310 -0.060379\n0.884001 0.054268 8.408409\nZn Sb O\n4 4 10\ndirect\n0.536326 0.035547 0.177695 Zn\n0.211895 -0.030055 0.827297 Zn\n0.463680 0.535545 0.322302 Zn\n0.788117 0.469950 0.672703 Zn\n-0.112419 0.840515 0.475604 Sb\n0.367284 0.208541 0.514154 Sb\n-0.367286 0.708540 0.985851 Sb\n0.112420 0.340514 0.024391 Sb\n0.448992 0.749340 0.352094 O\n0.025642 0.491657 0.198315 O\n0.550985 0.249338 0.147904 O\n0.206038 0.741548 0.839061 O\n0.351203 0.462255 0.546558 O\n0.326795 0.000657 0.595875 O\n-0.326790 0.500654 0.904127 O\n-0.351199 0.962250 -0.046559 O\n-0.025639 0.991662 0.301684 O\n0.793967 0.241548 0.660944 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zn",
"Sb",
"O"
],
"chemical_system": "O-Sb-Zn",
"density": 5.778778227616337,
"density_atomic": 0.0689371374153427,
"volume": 261.107447667154,
"volume_molar": 8.735698907421861,
"formula_full": "Zn4 Sb4 O10",
"formula_reduced": "Zn2Sb2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.434985611111111,
"spacegroup": 36
},
{
"id": "jvasp-29756",
"created_at": "2022-09-04T14:37:14.795504Z",
"updated_at": "2022-09-04T14:37:14.795528Z",
"structure_string": "Ga4 Fe4 S10\n1.0\n3.603000 -0.000040 0.000080\n-1.801528 3.120256 -0.000090\n0.000398 -0.000449 29.988062\nGa Fe S\n4 4 10\ndirect\n0.333291 0.666719 0.911821 Ga\n0.666671 0.333376 0.088179 Ga\n0.666651 0.333396 0.411820 Ga\n0.333401 0.666526 0.588180 Ga\n0.000029 -0.000070 0.704448 Fe\n0.000006 0.000042 0.204446 Fe\n-0.000039 -0.000041 0.795554 Fe\n-0.000014 0.000053 0.295552 Fe\n0.333331 0.666738 0.447387 S\n0.666680 0.333370 0.162974 S\n0.333365 0.666693 0.052612 S\n0.666723 0.333199 0.552613 S\n0.666653 0.333394 0.337025 S\n0.333369 0.666582 0.662974 S\n0.666609 0.333394 0.947388 S\n0.333287 0.666644 0.837026 S\n0.333332 0.666710 0.249999 S\n0.666660 0.333283 0.750001 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"Fe",
"S"
],
"chemical_system": "Fe-Ga-S",
"density": 4.053289887590412,
"density_atomic": 0.053391534136480706,
"volume": 337.13209951952257,
"volume_molar": 11.279205322338298,
"formula_full": "Ga4 Fe4 S10",
"formula_reduced": "Ga2Fe2S5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.976540627777778,
"spacegroup": 194
},
{
"id": "jvasp-9557",
"created_at": "2022-09-04T14:37:08.482391Z",
"updated_at": "2022-09-04T14:37:08.482414Z",
"structure_string": "Ca4 Sn4 O10\n1.0\n4.143274 0.000000 0.000000\n0.000000 5.564560 0.000000\n0.000000 -0.000000 10.599151\nCa Sn O\n4 4 10\ndirect\n0.499999 0.141741 0.853019 Ca\n0.499999 0.858259 0.146981 Ca\n0.499999 0.641741 0.646981 Ca\n0.499999 0.358259 0.353019 Ca\n0.000000 0.164523 0.604023 Sn\n0.000000 0.835477 0.395977 Sn\n0.000000 0.335477 0.104023 Sn\n0.000000 0.664523 0.895977 Sn\n0.499999 0.214193 0.624666 O\n0.000000 0.853942 0.722782 O\n0.499999 0.714193 0.875334 O\n0.499999 0.285807 0.124666 O\n0.000000 0.500000 0.500000 O\n0.000000 0.646058 0.222782 O\n0.000000 0.146058 0.277218 O\n0.000000 0.000000 0.000000 O\n0.000000 0.353942 0.777218 O\n0.499999 0.785807 0.375334 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"O"
],
"chemical_system": "Ca-O-Sn",
"density": 5.4031921511435606,
"density_atomic": 0.07365919046032449,
"volume": 244.36869163930677,
"volume_molar": 8.175681435494113,
"formula_full": "Ca4 Sn4 O10",
"formula_reduced": "Ca2Sn2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.3412074925925923,
"spacegroup": 55
}
]
}