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=-chemical_system&page=716",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=714",
"results": [
{
"id": "jvasp-19302",
"created_at": "2022-09-04T14:37:16.346309Z",
"updated_at": "2022-09-04T14:37:16.346336Z",
"structure_string": "Mn4 Zn6 O14\n1.0\n5.143257 0.000000 -0.000000\n0.000000 4.913722 -1.325397\n-0.000000 -0.117784 9.334493\nMn Zn O\n4 6 14\ndirect\n0.752170 0.351290 0.204095 Mn\n0.252170 0.648710 0.795905 Mn\n0.252170 0.852803 0.204094 Mn\n0.752170 0.147197 0.795905 Mn\n0.709313 0.750729 -0.000000 Zn\n0.209313 0.249270 -0.000000 Zn\n0.805825 0.563853 0.605226 Zn\n0.305825 0.436147 0.394773 Zn\n0.805825 0.958626 0.394773 Zn\n0.305825 0.041374 0.605226 Zn\n0.316103 0.633020 -0.000000 O\n0.816104 0.366980 -0.000000 O\n0.437028 0.144444 0.153404 O\n0.937029 0.855557 0.846595 O\n0.058678 0.565636 0.260946 O\n0.558678 0.434365 0.739054 O\n0.193594 0.061521 0.403463 O\n0.058678 0.304689 0.739054 O\n0.693594 0.341944 0.403463 O\n0.193594 0.658056 0.596536 O\n0.937029 0.008961 0.153404 O\n0.693594 0.938479 0.596536 O\n0.558678 0.695311 0.260945 O\n0.437028 0.991040 0.846595 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.906078643326651,
"density_atomic": 0.1020827496825955,
"volume": 235.10338499524036,
"volume_molar": 5.899273656640872,
"formula_full": "Mn4 Zn6 O14",
"formula_reduced": "Mn2Zn3O7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 1.957221681896552,
"spacegroup": 36
},
{
"id": "jvasp-11571",
"created_at": "2022-09-04T14:37:19.997507Z",
"updated_at": "2022-09-04T14:37:19.997524Z",
"structure_string": "Mn3 Zn2 O8\n1.0\n4.817736 0.213767 -1.107927\n-0.838413 4.982996 -2.684341\n0.279441 -0.189557 5.658965\nMn Zn O\n3 2 8\ndirect\n0.500001 1.000000 0.000001 Mn\n0.000000 0.744844 0.000000 Mn\n0.000000 0.255157 0.000000 Mn\n0.599442 0.707503 0.415004 Zn\n0.400559 0.292498 0.584995 Zn\n0.097668 0.393827 0.787655 O\n0.902334 0.606173 0.212344 O\n0.130401 0.899065 0.798130 O\n0.869600 0.100935 0.201870 O\n0.365701 0.341500 0.228807 O\n0.365702 0.887309 0.228808 O\n0.634300 0.112692 0.771192 O\n0.634300 0.658501 0.771192 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.186821418695938,
"density_atomic": 0.09585429443195283,
"volume": 135.62250994637208,
"volume_molar": 6.282598808627328,
"formula_full": "Mn3 Zn2 O8",
"formula_reduced": "Mn3Zn2O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.5893846557029176,
"spacegroup": 12
},
{
"id": "jvasp-10858",
"created_at": "2022-09-04T14:36:33.907024Z",
"updated_at": "2022-09-04T14:36:33.907046Z",
"structure_string": "Mn4 Zn1 O8\n1.0\n4.868917 -0.151051 3.453572\n1.702811 4.563947 3.453572\n-0.224946 -0.151051 5.965142\nMn Zn O\n4 1 8\ndirect\n0.500000 1.000000 0.500000 Mn\n0.999999 0.500001 0.500000 Mn\n0.500000 0.500000 -0.000001 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500001 0.499998 Zn\n0.758306 0.274388 0.758306 O\n0.241692 0.241694 0.725612 O\n0.241692 0.725614 0.241692 O\n0.725611 0.241694 0.241693 O\n0.267539 0.267540 0.267539 O\n0.732460 0.732462 0.732460 O\n0.274388 0.758308 0.758306 O\n0.758307 0.758308 0.274387 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 4.921425949070808,
"density_atomic": 0.09325470360666346,
"volume": 139.4031560577615,
"volume_molar": 6.457734062831435,
"formula_full": "Mn4 Zn1 O8",
"formula_reduced": "Mn4ZnO8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.1478274896551723,
"spacegroup": 166
},
{
"id": "jvasp-10048",
"created_at": "2022-09-04T14:37:26.898893Z",
"updated_at": "2022-09-04T14:37:26.898900Z",
"structure_string": "Mn4 Zn2 O8\n1.0\n6.025909 0.037588 -0.091020\n3.045506 5.199796 -0.091020\n2.949487 1.702887 4.816493\nMn Zn O\n4 2 8\ndirect\n0.989965 0.989966 0.010035 Mn\n0.260035 0.260035 0.239965 Mn\n0.625000 0.625001 0.125000 Mn\n0.625000 0.625001 0.625000 Mn\n0.125000 0.625001 0.625000 Zn\n0.625000 0.125001 0.625000 Zn\n0.402247 0.402247 0.358082 O\n0.404390 0.848250 0.373681 O\n0.402247 0.402248 0.837426 O\n0.848249 0.404390 0.373681 O\n0.401751 0.845612 0.876319 O\n0.845611 0.401752 0.876319 O\n0.847754 0.847755 0.412573 O\n0.847754 0.847755 0.891917 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.220784030876724,
"density_atomic": 0.09197576066056194,
"volume": 152.21401703506677,
"volume_molar": 6.547530258787214,
"formula_full": "Mn4 Zn2 O8",
"formula_reduced": "Mn2ZnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.4574626975369456,
"spacegroup": 74
},
{
"id": "jvasp-10645",
"created_at": "2022-09-04T14:37:27.862314Z",
"updated_at": "2022-09-04T14:37:27.862342Z",
"structure_string": "Mn4 Zn2 O8\n1.0\n5.983023 -0.016775 -0.011862\n2.976985 5.156288 -0.000000\n2.976985 1.718763 4.861394\nMn Zn O\n4 2 8\ndirect\n0.265186 0.244938 0.244938 Mn\n0.624665 0.127338 0.623998 Mn\n0.624664 0.623999 0.127338 Mn\n0.624664 0.623999 0.623998 Mn\n0.986307 0.004565 0.004565 Zn\n0.121749 0.626084 0.626083 Zn\n0.411684 0.377409 0.377408 O\n0.411684 0.377409 0.833497 O\n0.411684 0.833498 0.377408 O\n0.861647 0.379451 0.379451 O\n0.392145 0.869285 0.869284 O\n0.837969 0.415380 0.873325 O\n0.837969 0.873326 0.415379 O\n0.837969 0.873326 0.873325 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.285894132384182,
"density_atomic": 0.0931228203890275,
"volume": 150.33908918902972,
"volume_molar": 6.466879691618081,
"formula_full": "Mn4 Zn2 O8",
"formula_reduced": "Mn2ZnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.449982697536946,
"spacegroup": 160
},
{
"id": "jvasp-11014",
"created_at": "2022-09-04T14:37:12.522099Z",
"updated_at": "2022-09-04T14:37:12.522125Z",
"structure_string": "Mn4 Zn2 O8\n1.0\n5.094328 -0.000000 -2.674587\n-1.404192 4.896981 -2.674587\n0.004585 0.006084 6.197649\nMn Zn O\n4 2 8\ndirect\n-0.000001 -0.000000 0.500000 Mn\n0.000000 0.500000 -0.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.374999 0.624999 0.749999 Zn\n0.625000 0.375000 0.249999 Zn\n0.754813 0.779348 0.509625 O\n0.769724 0.245186 0.990373 O\n0.220651 0.245186 0.990373 O\n0.245187 0.220651 0.490374 O\n0.245187 0.769724 0.490373 O\n0.230276 0.754813 0.009625 O\n0.754813 0.230275 0.509625 O\n0.779349 0.754813 0.009625 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.13431622003108,
"density_atomic": 0.09045243722328766,
"volume": 154.77747675764778,
"volume_molar": 6.657798225087024,
"formula_full": "Mn4 Zn2 O8",
"formula_reduced": "Mn2ZnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.448344126108374,
"spacegroup": 141
},
{
"id": "jvasp-108964",
"created_at": "2022-09-04T14:38:11.092431Z",
"updated_at": "2022-09-04T14:38:11.092451Z",
"structure_string": "Mn2 Zn2 O6\n1.0\n4.440499 0.004160 3.145355\n1.628764 4.131002 3.145355\n0.006106 0.004160 5.441622\nMn Zn O\n2 2 6\ndirect\n0.341538 0.341538 0.341537 Mn\n0.658462 0.658461 0.658461 Mn\n0.133356 0.133356 0.133356 Zn\n0.866645 0.866644 0.866642 Zn\n0.062611 0.716373 0.451717 O\n0.451719 0.062611 0.716372 O\n0.716373 0.451718 0.062610 O\n0.283627 0.548282 0.937388 O\n0.548282 0.937388 0.283625 O\n0.937389 0.283626 0.548281 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.609578454692243,
"density_atomic": 0.10033449733045383,
"volume": 99.66661782402502,
"volume_molar": 6.002064016094035,
"formula_full": "Mn2 Zn2 O6",
"formula_reduced": "MnZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.754681628275862,
"spacegroup": 148
},
{
"id": "jvasp-91270",
"created_at": "2022-09-04T14:36:18.900652Z",
"updated_at": "2022-09-04T14:36:18.900679Z",
"structure_string": "Yb6 Mn6 O18\n1.0\n5.946328 -0.000000 -0.000000\n-2.973164 5.149672 -0.000000\n-0.000000 -0.000000 11.537877\nYb Mn O\n6 6 18\ndirect\n0.000000 0.000000 0.275383 Yb\n0.333333 0.666667 0.232911 Yb\n0.666667 0.333333 0.732911 Yb\n0.333333 0.666667 0.732911 Yb\n0.666667 0.333333 0.232911 Yb\n0.000000 0.000000 0.775384 Yb\n0.333330 0.000000 0.000303 Mn\n0.333330 0.333330 0.500303 Mn\n0.000000 0.666670 0.500303 Mn\n0.000000 0.333330 0.000303 Mn\n0.666671 0.666670 0.000303 Mn\n0.666670 0.000000 0.500303 Mn\n0.698236 0.000000 0.654415 O\n0.698236 0.698236 0.154415 O\n0.000000 0.301764 0.154415 O\n0.666667 0.333333 0.015917 O\n0.301764 0.000000 0.154415 O\n0.636204 0.000000 0.346563 O\n0.636204 0.636204 0.846564 O\n0.000000 0.363796 0.846564 O\n0.000000 0.636204 0.346563 O\n0.363796 0.363796 0.346563 O\n0.363796 0.000000 0.846564 O\n0.000000 0.000000 0.479116 O\n0.000000 0.000000 0.979116 O\n0.333333 0.666667 0.015917 O\n0.666667 0.333333 0.515917 O\n0.333333 0.666667 0.515917 O\n0.301764 0.301764 0.654415 O\n0.000000 0.698236 0.654415 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Yb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Yb",
"density": 7.7824746506245965,
"density_atomic": 0.08491157966039692,
"volume": 353.30870206377887,
"volume_molar": 7.092249118536596,
"formula_full": "Yb6 Mn6 O18",
"formula_reduced": "YbMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.779739688275862,
"spacegroup": 185
},
{
"id": "jvasp-58467",
"created_at": "2022-09-04T14:37:03.775370Z",
"updated_at": "2022-09-04T14:37:03.775395Z",
"structure_string": "Y2 Mn4 O8\n1.0\n5.492388 0.032215 3.075741\n1.817617 5.183014 3.075741\n0.045155 0.032215 6.294798\nY Mn O\n2 4 8\ndirect\n0.617173 0.617173 0.617172 Y\n0.382827 0.382828 0.382827 Y\n0.000000 0.500000 -0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 -0.000000 Mn\n-0.000001 0.000000 0.500000 Mn\n0.197327 0.757688 0.757688 O\n0.242311 0.242313 0.802673 O\n0.242313 0.802673 0.242312 O\n0.246152 0.246152 0.246152 O\n0.757688 0.757688 0.197326 O\n0.802673 0.242313 0.242312 O\n0.757687 0.197328 0.757688 O\n0.753848 0.753849 0.753848 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 4.909859238537159,
"density_atomic": 0.07876375923153167,
"volume": 177.74672179937482,
"volume_molar": 7.645826987888541,
"formula_full": "Y2 Mn4 O8",
"formula_reduced": "YMn2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.09968056182266,
"spacegroup": 166
},
{
"id": "jvasp-113698",
"created_at": "2022-09-04T14:38:45.727552Z",
"updated_at": "2022-09-04T14:38:45.727569Z",
"structure_string": "Y1 Mn1 O4\n1.0\n-1.926528 1.926528 5.414687\n1.926528 -1.926528 5.414687\n1.926528 1.926528 -5.414687\nY Mn O\n1 1 4\ndirect\n0.750001 0.250000 0.500001 Y\n0.000000 0.000000 0.000000 Mn\n0.979478 0.479477 0.500001 O\n0.831295 0.831295 0.000000 O\n0.520524 0.020523 0.500001 O\n0.168706 0.168706 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 4.293360496361991,
"density_atomic": 0.07463924733061718,
"volume": 80.38666270873269,
"volume_molar": 8.068329967643853,
"formula_full": "Y1 Mn1 O4",
"formula_reduced": "YMnO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.725484448563219,
"spacegroup": 119
},
{
"id": "jvasp-8233",
"created_at": "2022-09-04T14:36:35.430110Z",
"updated_at": "2022-09-04T14:36:35.430135Z",
"structure_string": "Y1 Mn1 O3\n1.0\n3.795210 0.000000 0.000000\n0.000000 3.795210 0.000000\n0.000000 0.000000 3.795383\nY Mn O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 5.827278499926681,
"density_atomic": 0.09146243786174095,
"volume": 54.66725047891509,
"volume_molar": 6.584277546924083,
"formula_full": "Y1 Mn1 O3",
"formula_reduced": "YMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.534398638275862,
"spacegroup": 221
},
{
"id": "jvasp-59587",
"created_at": "2022-09-04T14:36:52.853482Z",
"updated_at": "2022-09-04T14:36:52.853493Z",
"structure_string": "Y2 Mn2 O6\n1.0\n1.797452 -3.113279 -0.000000\n1.797452 3.113279 0.000000\n0.000000 0.000000 11.308668\nY Mn O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.666666 0.333332 0.750000 Mn\n0.333332 0.666666 0.250000 Mn\n0.333332 0.666666 0.415566 O\n0.666666 0.333332 0.915566 O\n0.666666 0.333332 0.584434 O\n0.333332 0.666666 0.084434 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 5.033918823490495,
"density_atomic": 0.07901020821303469,
"volume": 126.56592389982151,
"volume_molar": 7.621978091441734,
"formula_full": "Y2 Mn2 O6",
"formula_reduced": "YMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.491952638275862,
"spacegroup": 194
}
]
}