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=-elements&page=453",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=451",
"results": [
{
"id": "jvasp-119310",
"created_at": "2022-09-04T14:38:47.119118Z",
"updated_at": "2022-09-04T14:38:47.119146Z",
"structure_string": "Li2 Fe2 Mo4 O16\n1.0\n6.227524 -0.087205 -2.227214\n-2.067194 6.864443 -0.094783\n-0.035693 0.015516 6.943695\nLi Fe Mo O\n2 2 4 16\ndirect\n0.775171 0.447011 0.274694 Li\n0.224830 0.552990 0.725307 Li\n0.407934 0.096261 0.326018 Fe\n0.592066 0.903740 0.673983 Fe\n0.820559 0.964005 0.227521 Mo\n0.334814 0.573778 0.285409 Mo\n0.179442 0.035996 0.772479 Mo\n0.665187 0.426223 0.714592 Mo\n0.294172 0.282287 0.740503 O\n0.123314 0.049464 0.362606 O\n0.097413 0.482604 0.348588 O\n0.759777 0.962360 0.958955 O\n0.470928 0.374007 0.342190 O\n0.239759 0.571953 0.023075 O\n0.902588 0.517397 0.651413 O\n0.876687 0.950536 0.637395 O\n0.684143 0.136151 0.279354 O\n0.419827 0.845855 0.387381 O\n0.760242 0.428048 0.976925 O\n0.705828 0.717714 0.259498 O\n0.240223 0.037641 0.041046 O\n0.580174 0.154146 0.612619 O\n0.529073 0.625993 0.657810 O\n0.315858 0.863850 0.720647 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Mo",
"O"
],
"chemical_system": "Fe-Li-Mo-O",
"density": 4.306275372609101,
"density_atomic": 0.08132414716977425,
"volume": 295.11529890251444,
"volume_molar": 7.405107793418398,
"formula_full": "Li2 Fe2 Mo4 O16",
"formula_reduced": "LiFe(MoO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.430024608333333,
"spacegroup": 2
},
{
"id": "jvasp-112414",
"created_at": "2022-09-04T14:38:40.060141Z",
"updated_at": "2022-09-04T14:38:40.060161Z",
"structure_string": "Li2 Fe2 Ge4 O12\n1.0\n6.320741 0.046383 0.946476\n0.450286 6.304852 0.946476\n-0.054772 -0.051376 5.145036\nLi Fe Ge O\n2 2 4 12\ndirect\n0.268852 0.731148 0.250001 Li\n0.731149 0.268851 0.750002 Li\n0.912276 0.087723 0.250001 Fe\n0.087724 0.912276 0.750001 Fe\n0.399098 0.203690 0.294455 Ge\n0.796310 0.600901 0.205547 Ge\n0.600903 0.796309 0.705547 Ge\n0.203691 0.399097 0.794456 Ge\n0.643283 0.120681 0.124562 O\n0.565105 0.707017 0.400403 O\n0.356718 0.879317 0.875441 O\n0.120682 0.643282 0.624562 O\n0.189529 0.027038 0.383665 O\n0.707018 0.565104 0.900404 O\n0.810472 0.972961 0.616337 O\n0.027039 0.189528 0.883666 O\n0.292983 0.434895 0.099599 O\n0.972962 0.810471 0.116337 O\n0.434895 0.292982 0.599600 O\n0.879318 0.356716 0.375440 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ge",
"O"
],
"chemical_system": "Fe-Ge-Li-O",
"density": 4.913009080083334,
"density_atomic": 0.09730513291233814,
"volume": 205.5390029426087,
"volume_molar": 6.188924036952218,
"formula_full": "Li2 Fe2 Ge4 O12",
"formula_reduced": "LiFe(GeO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.24649284,
"spacegroup": 15
},
{
"id": "jvasp-50088",
"created_at": "2022-09-04T14:37:00.919044Z",
"updated_at": "2022-09-04T14:37:00.919072Z",
"structure_string": "Li1 Fe1 Cu1 S2\n1.0\n3.803555 0.002319 -0.003212\n-1.900005 -3.295156 0.001582\n-0.005998 0.000510 -6.258685\nLi Fe Cu S\n1 1 1 2\ndirect\n0.999774 0.999909 0.011071 Li\n0.666774 0.333390 0.621729 Fe\n0.333329 0.666651 0.366051 Cu\n0.666616 0.333306 0.245584 S\n0.333509 0.666747 0.755566 S\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"S"
],
"chemical_system": "Cu-Fe-Li-S",
"density": 4.033304544391591,
"density_atomic": 0.06376371061594341,
"volume": 78.41450805953889,
"volume_molar": 9.444464103213953,
"formula_full": "Li1 Fe1 Cu1 S2",
"formula_reduced": "LiFeCuS2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.47728119,
"spacegroup": 156
},
{
"id": "jvasp-42386",
"created_at": "2022-09-04T14:37:29.295990Z",
"updated_at": "2022-09-04T14:37:29.296019Z",
"structure_string": "Li3 Fe2 Cu2 O8\n1.0\n-5.501738 0.002885 0.093767\n-0.003201 -5.503642 -0.012725\n2.627020 2.739529 4.632583\nLi Fe Cu O\n3 2 2 8\ndirect\n-0.000000 -0.000000 0.500000 Li\n0.500000 0.500000 -0.000000 Li\n-0.000000 0.499999 0.499999 Li\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000001 0.000000 Cu\n0.282198 0.270179 0.540346 O\n0.262459 0.747231 0.494462 O\n0.702602 0.182863 0.907305 O\n0.702610 0.724450 0.907315 O\n0.297390 0.275550 0.092684 O\n0.297398 0.817137 0.092694 O\n0.737541 0.252769 0.505537 O\n0.717802 0.729821 0.459653 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.550654030620059,
"density_atomic": 0.10605520507442648,
"volume": 141.43577384507844,
"volume_molar": 5.678307590630593,
"formula_full": "Li3 Fe2 Cu2 O8",
"formula_reduced": "Li3Fe2(CuO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.172489993333334,
"spacegroup": 12
},
{
"id": "jvasp-42414",
"created_at": "2022-09-04T14:37:29.596608Z",
"updated_at": "2022-09-04T14:37:29.596628Z",
"structure_string": "Li2 Fe3 Cu1 O8\n1.0\n5.623485 -0.047739 0.056027\n-0.099590 5.789564 0.020273\n-2.720854 -2.798727 4.048390\nLi Fe Cu O\n2 3 1 8\ndirect\n-0.000000 0.499999 -0.000000 Li\n0.500001 0.499999 0.500000 Li\n0.000000 -0.000000 0.500000 Fe\n0.500001 0.000000 0.000000 Fe\n0.500001 -0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Cu\n0.241740 0.212081 0.970344 O\n0.720856 0.210677 0.959449 O\n0.251220 0.210614 0.489734 O\n0.739738 0.215415 0.475691 O\n0.260263 0.784583 0.524309 O\n0.748781 0.789385 0.510266 O\n0.279145 0.789322 0.040551 O\n0.758261 0.787918 0.029656 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.656261485727853,
"density_atomic": 0.10525824858912919,
"volume": 133.00620319694247,
"volume_molar": 5.7213005543224975,
"formula_full": "Li2 Fe3 Cu1 O8",
"formula_reduced": "Li2Fe3CuO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.5948646392857144,
"spacegroup": 12
},
{
"id": "jvasp-112834",
"created_at": "2022-09-04T14:38:44.220185Z",
"updated_at": "2022-09-04T14:38:44.220200Z",
"structure_string": "Li5 Fe5 Cu2 O12\n1.0\n5.032818 -0.047152 0.331781\n-2.336519 4.457820 0.331781\n0.097385 0.159304 9.504516\nLi Fe Cu O\n5 5 2 12\ndirect\n0.834741 0.666468 0.258446 Li\n0.682140 0.858181 0.739216 Li\n0.333531 0.165259 0.741554 Li\n0.141818 0.317859 0.260785 Li\n0.081109 0.918889 0.500000 Li\n0.922410 0.077590 -0.000000 Fe\n-0.008004 0.515812 0.741220 Fe\n0.484187 0.008003 0.258780 Fe\n0.583217 0.416783 -0.000000 Fe\n0.419467 0.580531 0.500000 Fe\n0.252467 0.747533 -0.000000 Cu\n0.750661 0.249339 0.500000 Cu\n0.203615 0.043458 0.123953 O\n0.075013 0.249071 0.612336 O\n0.750928 0.924986 0.387665 O\n0.845176 0.326719 0.129686 O\n0.673281 0.154824 0.870314 O\n0.697952 0.539509 0.622844 O\n0.460490 0.302047 0.377156 O\n0.581097 0.744269 0.111049 O\n0.255730 0.418902 0.888951 O\n0.352095 0.829672 0.629529 O\n0.170327 0.647903 0.370471 O\n0.956541 0.796384 0.876048 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.966307453019393,
"density_atomic": 0.11339186085325795,
"volume": 211.65540294870678,
"volume_molar": 5.310910954881797,
"formula_full": "Li5 Fe5 Cu2 O12",
"formula_reduced": "Li5Fe5(CuO6)2",
"formula_anonymous": "A2B5C5D12",
"energy_above_hull": 2.5249583499999995,
"spacegroup": 5
},
{
"id": "jvasp-42515",
"created_at": "2022-09-04T14:37:56.569850Z",
"updated_at": "2022-09-04T14:37:56.569874Z",
"structure_string": "Li4 Fe2 Cu3 O10\n1.0\n5.017789 0.090060 0.077077\n-1.471491 5.002118 -0.132845\n-1.657772 -2.289933 6.970876\nLi Fe Cu O\n4 2 3 10\ndirect\n0.221463 0.914487 0.401406 Li\n0.395077 0.291279 0.773106 Li\n0.604924 0.708723 0.226896 Li\n0.778539 0.085515 0.598596 Li\n0.094897 0.680133 0.686078 Fe\n0.905105 0.319868 0.313924 Fe\n0.000000 0.500000 0.000000 Cu\n0.693197 0.876762 0.892088 Cu\n0.306804 0.123239 0.107914 Cu\n0.878894 0.674524 0.458041 O\n0.566382 0.102161 0.331377 O\n0.793492 0.475622 0.755539 O\n0.206510 0.524379 0.244462 O\n0.056468 0.021706 0.834417 O\n0.121108 0.325478 0.541961 O\n0.334216 0.660720 0.917073 O\n0.665786 0.339282 0.082928 O\n0.433620 0.897840 0.668625 O\n0.943533 0.978296 0.165585 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.642841987326604,
"density_atomic": 0.10839671235086171,
"volume": 175.28206887401006,
"volume_molar": 5.555648902438439,
"formula_full": "Li4 Fe2 Cu3 O10",
"formula_reduced": "Li4Fe2Cu3O10",
"formula_anonymous": "A2B3C4D10",
"energy_above_hull": 2.081422492105263,
"spacegroup": 2
},
{
"id": "jvasp-112446",
"created_at": "2022-09-04T14:38:40.650622Z",
"updated_at": "2022-09-04T14:38:40.650637Z",
"structure_string": "Li3 Fe4 Cu1 O8\n1.0\n5.037020 0.010726 2.849784\n1.711018 4.737521 2.849784\n-0.041277 -0.029045 5.801992\nLi Fe Cu O\n3 4 1 8\ndirect\n0.000000 0.500000 -0.000000 Li\n-0.000000 0.000000 0.500000 Li\n0.500000 0.000000 -0.000001 Li\n0.500000 0.500001 0.499999 Fe\n0.000000 0.000000 0.000000 Fe\n-0.000000 0.500000 0.499999 Fe\n0.499999 0.000001 0.499999 Fe\n0.500000 0.500000 -0.000001 Cu\n0.248810 0.248811 0.279204 O\n0.259541 0.767599 0.732982 O\n0.767597 0.259543 0.732982 O\n0.749669 0.749669 0.265717 O\n0.250331 0.250332 0.734280 O\n0.232402 0.740459 0.267016 O\n0.740458 0.232403 0.267016 O\n0.751189 0.751191 0.720794 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 5.198895115983157,
"density_atomic": 0.11496094523620651,
"volume": 139.177700454057,
"volume_molar": 5.238423142421546,
"formula_full": "Li3 Fe4 Cu1 O8",
"formula_reduced": "Li3Fe4CuO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.610535653125,
"spacegroup": 12
},
{
"id": "jvasp-44746",
"created_at": "2022-09-04T14:38:11.235176Z",
"updated_at": "2022-09-04T14:38:11.235212Z",
"structure_string": "Li2 Fe1 Cu1 O4\n1.0\n0.000000 5.565729 0.356670\n2.782359 0.000000 0.000000\n0.000000 -2.182376 -4.717244\nLi Fe Cu O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 -0.000000 Li\n-0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Cu\n0.787155 0.000000 0.236272 O\n0.229810 0.500000 0.321471 O\n0.212844 0.000000 0.763727 O\n0.770189 0.500000 0.678528 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.6212376281217376,
"density_atomic": 0.11285916296325961,
"volume": 70.88480713439577,
"volume_molar": 5.335978578859795,
"formula_full": "Li2 Fe1 Cu1 O4",
"formula_reduced": "Li2FeCuO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.84761374375,
"spacegroup": 10
},
{
"id": "jvasp-104992",
"created_at": "2022-09-04T14:37:16.265362Z",
"updated_at": "2022-09-04T14:37:16.265399Z",
"structure_string": "Li2 Fe1 Cu1 O4\n1.0\n2.783841 0.000000 0.000000\n-0.000000 5.091714 2.144918\n-0.000000 0.445531 5.154370\nLi Fe Cu O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.500000 -0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Cu\n0.000000 0.787143 0.761664 O\n0.500000 0.230839 0.681742 O\n0.000000 0.212856 0.238336 O\n0.500000 0.769160 0.318259 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.653034054569662,
"density_atomic": 0.11363569045717126,
"volume": 70.40041705044386,
"volume_molar": 5.299515263005962,
"formula_full": "Li2 Fe1 Cu1 O4",
"formula_reduced": "Li2FeCuO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.84485874375,
"spacegroup": 10
},
{
"id": "jvasp-116890",
"created_at": "2022-09-04T14:38:46.168747Z",
"updated_at": "2022-09-04T14:38:46.168773Z",
"structure_string": "Li3 Fe1 Cu3 O8\n1.0\n5.006613 -0.063547 2.908828\n1.643968 4.729438 2.908828\n-0.090578 -0.063547 5.789582\nLi Fe Cu O\n3 1 3 8\ndirect\n-0.000000 -0.000000 0.500000 Li\n0.500000 -0.000000 0.000000 Li\n0.000000 0.500000 -0.000000 Li\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 -0.000001 0.500000 Cu\n0.262431 0.262431 0.262431 O\n0.774408 0.774408 0.229466 O\n0.229466 0.774408 0.774409 O\n0.737569 0.737569 0.737570 O\n0.774408 0.229465 0.774409 O\n0.225591 0.225591 0.770534 O\n0.770534 0.225591 0.225592 O\n0.225591 0.770534 0.225591 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.7028519265735405,
"density_atomic": 0.10746705152318127,
"volume": 139.57766392022407,
"volume_molar": 5.603708927197085,
"formula_full": "Li3 Fe1 Cu3 O8",
"formula_reduced": "Li3FeCu3O8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 1.8661183233333336,
"spacegroup": 166
},
{
"id": "jvasp-45083",
"created_at": "2022-09-04T14:38:07.415572Z",
"updated_at": "2022-09-04T14:38:07.415604Z",
"structure_string": "Li3 Fe3 Cu1 O8\n1.0\n5.677568 0.000848 0.000031\n-0.000932 5.765346 0.024745\n-2.838169 -2.813131 4.032769\nLi Fe Cu O\n3 3 1 8\ndirect\n0.001038 0.501933 0.002063 Li\n0.499778 0.501915 0.500708 Li\n0.000947 0.501914 0.500721 Li\n0.503128 0.000561 0.006261 Fe\n-0.005618 0.000604 0.497502 Fe\n0.503118 0.000605 0.497499 Fe\n-0.000643 -0.001958 -0.001282 Cu\n0.260867 0.782585 0.521745 O\n0.753384 0.778801 0.506771 O\n0.272071 0.778773 0.025462 O\n0.743997 0.231922 0.487980 O\n0.753426 0.778807 0.025455 O\n0.244613 0.214531 0.489225 O\n0.725298 0.214523 0.969937 O\n0.244600 0.214496 0.969953 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-Li-O",
"density": 4.764601739342694,
"density_atomic": 0.11329229838959223,
"volume": 132.40087996465255,
"volume_molar": 5.31557823930001,
"formula_full": "Li3 Fe3 Cu1 O8",
"formula_reduced": "Li3Fe3CuO8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 2.48459433,
"spacegroup": 166
}
]
}