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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=spacegroup&page=46",
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"results": [
{
"id": "oqmd-694337",
"created_at": "2022-09-04T15:18:01.691512Z",
"updated_at": "2022-09-04T15:18:01.691551Z",
"structure_string": "Li8 Mn2 W2 O11\n1.0\n-5.195762 -8.979958 0.043153\n-2.539798 4.455986 0.007942\n1.770328 0.018990 -4.802906\nLi Mn O W\n8 2 11 2\ndirect\n0.997838 0.998523 0.500624 Li\n0.174790 0.656987 0.501728 Li\n0.831796 0.328012 0.501867 Li\n0.685448 0.650618 0.508991 Li\n0.493758 0.031010 0.516390 Li\n0.318390 0.315828 0.528465 Li\n0.243537 0.505234 0.983829 Li\n0.752444 0.506416 0.989619 Li\n0.914342 0.162201 0.001696 Mn\n0.427184 0.210811 0.010854 Mn\n0.966803 0.605907 0.229928 O\n0.772988 0.899304 0.239444 O\n0.128034 0.228794 0.240569 O\n0.280025 0.919822 0.240635 O\n0.618315 0.199299 0.250212 O\n0.689296 0.028451 0.727783 O\n0.542342 0.435562 0.743957 O\n0.888774 0.747466 0.757250 O\n0.045175 0.447561 0.758854 O\n0.387782 0.759302 0.769935 O\n0.199168 0.074588 0.772736 O\n0.086026 0.835465 0.001234 W\n0.588256 0.845307 0.990959 W\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"W"
],
"chemical_system": "Li-Mn-O-W",
"density": 5.345457645242172,
"density_atomic": 0.10441669255076684,
"volume": 220.27129415938475,
"volume_molar": 5.7674119078920905,
"formula_full": "Li8 Mn2 W2 O11",
"formula_reduced": "Li8Mn2W2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -2.1766392234387,
"spacegroup": 1
},
{
"id": "oqmd-694308",
"created_at": "2022-09-04T15:18:01.704011Z",
"updated_at": "2022-09-04T15:18:01.704036Z",
"structure_string": "Li8 Mn2 Rh2 O11\n1.0\n-4.963268 -8.713660 -0.063548\n-2.508413 4.372205 0.007372\n1.670844 -0.026445 -4.731636\nLi Mn O Rh\n8 2 11 2\ndirect\n0.750376 0.502352 0.002445 Li\n0.998378 0.992598 0.489271 Li\n0.670414 0.664952 0.494653 Li\n0.832482 0.341387 0.499910 Li\n0.331675 0.373716 0.504419 Li\n0.159152 0.635208 0.513038 Li\n0.522442 0.010708 0.526913 Li\n0.247823 0.467824 0.974060 Li\n0.581355 0.834227 0.007073 Mn\n0.081239 0.837207 0.983705 Mn\n0.977235 0.598649 0.233738 O\n0.779455 0.917385 0.233921 O\n0.126568 0.237087 0.234182 O\n0.460673 0.593003 0.237551 O\n0.614428 0.221752 0.243556 O\n0.206094 0.062109 0.750311 O\n0.876425 0.757527 0.752568 O\n0.529358 0.424763 0.762935 O\n0.386003 0.765187 0.766745 O\n0.047687 0.442107 0.773633 O\n0.706667 0.071804 0.777262 O\n0.413495 0.163117 0.004627 Rh\n0.917790 0.165347 0.999137 Rh\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Rh"
],
"chemical_system": "Li-Mn-O-Rh",
"density": 4.401323725494567,
"density_atomic": 0.1114061650124541,
"volume": 206.45177039734588,
"volume_molar": 5.4055722673218165,
"formula_full": "Li8 Mn2 Rh2 O11",
"formula_reduced": "Li8Mn2Rh2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -1.81312079126478,
"spacegroup": 1
},
{
"id": "oqmd-694470",
"created_at": "2022-09-04T15:18:01.810822Z",
"updated_at": "2022-09-04T15:18:01.810851Z",
"structure_string": "Ge4 O11\n1.0\n-5.060925 -9.131321 0.693848\n-2.595863 4.602776 0.399955\n2.367878 -0.038100 -4.051851\nGe O\n4 11\ndirect\n0.063780 0.858530 0.006974 Ge\n0.415877 0.111382 0.935768 Ge\n0.567863 0.786598 0.982624 Ge\n0.924248 0.201182 0.987332 Ge\n0.590955 0.159503 0.222083 O\n0.040422 0.670745 0.260230 O\n0.832882 0.062872 0.263734 O\n0.566553 0.669911 0.326048 O\n0.146273 0.318499 0.377180 O\n0.332380 0.655882 0.577987 O\n0.941017 0.332390 0.651970 O\n0.459238 0.323330 0.705835 O\n0.661079 0.942536 0.707082 O\n0.885074 0.808081 0.734201 O\n0.246349 0.045006 0.979224 O\n",
"nsites": 15,
"nelements": 2,
"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 4.44709580312403,
"density_atomic": 0.08610280273021194,
"volume": 174.21035697293007,
"volume_molar": 6.994128610272216,
"formula_full": "Ge4 O11",
"formula_reduced": "Ge4O11",
"formula_anonymous": "A4B11",
"formation_energy": -1.24392041164442,
"spacegroup": 1
},
{
"id": "oqmd-694440",
"created_at": "2022-09-04T15:18:01.848822Z",
"updated_at": "2022-09-04T15:18:01.848848Z",
"structure_string": "Sn2 O5\n1.0\n-2.835683 -5.604782 -0.074366\n-2.378697 5.415155 0.399079\n2.074610 -0.092255 -3.485730\nO Sn\n5 2\ndirect\n0.254867 0.253410 0.240970 O\n0.032643 0.655715 0.303398 O\n0.936803 0.312210 0.633646 O\n0.685409 0.691469 0.711541 O\n0.489322 0.073230 0.878133 O\n0.878172 0.175289 0.058584 Sn\n0.068787 0.773105 0.870092 Sn\n",
"nsites": 7,
"nelements": 2,
"elements": [
"O",
"Sn"
],
"chemical_system": "O-Sn",
"density": 5.486332823500945,
"density_atomic": 0.07286197012612451,
"volume": 96.07206596092526,
"volume_molar": 8.26513577600995,
"formula_full": "Sn2 O5",
"formula_reduced": "Sn2O5",
"formula_anonymous": "A2B5",
"formation_energy": -1.21461154329945,
"spacegroup": 1
},
{
"id": "oqmd-694299",
"created_at": "2022-09-04T15:18:01.696704Z",
"updated_at": "2022-09-04T15:18:01.696723Z",
"structure_string": "Li8 Ti2 Mn2 O11\n1.0\n-5.019087 -8.708304 0.103177\n-2.578992 4.393720 -0.010848\n1.765894 0.020053 -4.747268\nLi Mn O Ti\n8 2 11 2\ndirect\n0.757291 0.509016 0.005791 Li\n0.344265 0.416936 0.480002 Li\n0.667776 0.666523 0.489188 Li\n0.830955 0.350914 0.503774 Li\n0.526817 0.017140 0.504541 Li\n0.998884 0.976262 0.505494 Li\n0.151424 0.617817 0.542285 Li\n0.243354 0.451474 0.976020 Li\n0.077085 0.816734 0.017541 Mn\n0.585611 0.849193 0.999220 Mn\n0.458930 0.584616 0.210845 O\n0.787239 0.934174 0.234236 O\n0.604438 0.250869 0.235132 O\n0.973120 0.577549 0.251123 O\n0.118308 0.211536 0.252308 O\n0.521683 0.392384 0.710817 O\n0.383053 0.776471 0.756618 O\n0.875767 0.771731 0.762322 O\n0.712958 0.080853 0.775443 O\n0.042999 0.427889 0.798785 O\n0.207464 0.040993 0.801695 O\n0.913486 0.151218 0.003099 Ti\n0.431869 0.199187 0.953527 Ti\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Ti"
],
"chemical_system": "Li-Mn-O-Ti",
"density": 3.445614566880011,
"density_atomic": 0.10917754895065052,
"volume": 210.66602264899956,
"volume_molar": 5.515914964094016,
"formula_full": "Li8 Ti2 Mn2 O11",
"formula_reduced": "Li8Ti2Mn2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -2.44476133202881,
"spacegroup": 1
},
{
"id": "oqmd-694471",
"created_at": "2022-09-04T15:18:01.865556Z",
"updated_at": "2022-09-04T15:18:01.865593Z",
"structure_string": "Mo4 O11\n1.0\n-5.240992 -8.781411 -0.031373\n-2.646296 4.411135 0.028064\n1.799162 -0.029944 -4.533931\nMo O\n4 11\ndirect\n0.585550 0.850900 0.090513 Mo\n0.402554 0.144521 0.917537 Mo\n0.894578 0.194478 0.949378 Mo\n0.080773 0.752888 0.962579 Mo\n0.287342 0.969562 0.208121 O\n0.788240 0.968999 0.231890 O\n0.589748 0.206788 0.244817 O\n0.469018 0.579468 0.248265 O\n0.004517 0.575838 0.265513 O\n0.037107 0.369816 0.720596 O\n0.207138 0.037161 0.734628 O\n0.406876 0.800271 0.756790 O\n0.705740 0.088235 0.760456 O\n0.525781 0.445525 0.778483 O\n0.938230 0.861936 0.866622 O\n",
"nsites": 15,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 4.426620966347586,
"density_atomic": 0.07143610354057177,
"volume": 209.97785792559117,
"volume_molar": 8.430108112741276,
"formula_full": "Mo4 O11",
"formula_reduced": "Mo4O11",
"formula_anonymous": "A4B11",
"formation_energy": -2.00866910097775,
"spacegroup": 1
},
{
"id": "oqmd-694262",
"created_at": "2022-09-04T15:18:01.741055Z",
"updated_at": "2022-09-04T15:18:01.741083Z",
"structure_string": "Li8 Y4 O11\n1.0\n-5.115955 -10.549061 -0.144378\n-2.540758 5.263572 -0.067670\n1.629958 0.002351 -4.851697\nLi O Y\n8 11 4\ndirect\n0.291273 0.564748 0.262473 Li\n0.933936 0.872474 0.389923 Li\n0.115907 0.602068 0.441494 Li\n0.805110 0.344199 0.448472 Li\n0.690348 0.615495 0.478430 Li\n0.557193 0.071264 0.522042 Li\n0.216885 0.396130 0.675658 Li\n0.750399 0.452938 0.959917 Li\n0.755375 0.820698 0.177974 O\n0.599816 0.158212 0.191507 O\n0.946857 0.556905 0.227184 O\n0.272300 0.876777 0.258688 O\n0.090274 0.229968 0.295866 O\n0.397588 0.750709 0.636877 O\n0.722017 0.078532 0.700139 O\n0.903535 0.794607 0.726853 O\n0.574053 0.410195 0.734094 O\n0.126268 0.584620 0.814028 O\n0.321705 0.335263 0.966982 O\n0.100499 0.916084 0.030329 Y\n0.557011 0.756664 0.918082 Y\n0.400835 0.059250 0.933933 Y\n0.922035 0.179159 0.950337 Y\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Li",
"O",
"Y"
],
"chemical_system": "Li-O-Y",
"density": 3.7058980867293494,
"density_atomic": 0.087423258853499,
"volume": 263.0878818935661,
"volume_molar": 6.888488073970914,
"formula_full": "Li8 Y4 O11",
"formula_reduced": "Li8Y4O11",
"formula_anonymous": "A4B8C11",
"formation_energy": -2.56578524585506,
"spacegroup": 1
},
{
"id": "oqmd-694293",
"created_at": "2022-09-04T15:18:01.744112Z",
"updated_at": "2022-09-04T15:18:01.744141Z",
"structure_string": "Li8 Pa2 Mn2 O11\n1.0\n-5.210017 -9.869669 -0.117274\n-2.611558 4.938246 -0.101643\n1.622112 0.020879 -4.881135\nLi Mn O Pa\n8 2 11 2\ndirect\n0.175366 0.605802 0.478163 Li\n0.480901 0.058958 0.490753 Li\n0.966182 0.037170 0.491389 Li\n0.834306 0.328661 0.496153 Li\n0.700386 0.607572 0.499080 Li\n0.296501 0.330916 0.541129 Li\n0.223363 0.503989 0.997733 Li\n0.755623 0.491754 0.999085 Li\n0.423904 0.130100 0.976356 Mn\n0.914967 0.161288 0.997489 Mn\n0.610687 0.204142 0.228652 O\n0.767539 0.878652 0.239108 O\n0.954913 0.560709 0.239500 O\n0.283615 0.888455 0.240254 O\n0.114873 0.222764 0.272460 O\n0.386667 0.765010 0.713753 O\n0.548484 0.437237 0.718754 O\n0.049354 0.444394 0.750783 O\n0.891485 0.777616 0.752621 O\n0.714842 0.096939 0.759099 O\n0.284793 0.252564 0.892997 O\n0.089710 0.849317 0.003643 Pa\n0.574369 0.805573 0.974052 Pa\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Pa"
],
"chemical_system": "Li-Mn-O-Pa",
"density": 5.253596616165333,
"density_atomic": 0.09056621166074946,
"volume": 253.95784562741053,
"volume_molar": 6.649434319454856,
"formula_full": "Li8 Pa2 Mn2 O11",
"formula_reduced": "Li8Pa2Mn2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -2.38591904778652,
"spacegroup": 1
},
{
"id": "oqmd-694329",
"created_at": "2022-09-04T15:18:01.762822Z",
"updated_at": "2022-09-04T15:18:01.762861Z",
"structure_string": "Li8 Mn2 Si2 O11\n1.0\n-4.968382 -8.547253 -0.047610\n-2.453404 4.256640 0.036113\n1.687705 -0.028785 -4.672417\nLi Mn O Si\n8 2 11 2\ndirect\n0.354045 0.415038 0.481197 Li\n0.670083 0.670469 0.495044 Li\n0.001585 0.984540 0.499362 Li\n0.814470 0.313669 0.512805 Li\n0.522949 0.035894 0.521152 Li\n0.158628 0.621119 0.530004 Li\n0.246799 0.459277 0.976320 Li\n0.741105 0.499913 0.994110 Li\n0.916124 0.174230 0.010779 Mn\n0.421432 0.174118 0.987241 Mn\n0.469492 0.596531 0.202574 O\n0.774632 0.927370 0.218692 O\n0.607266 0.203510 0.220044 O\n0.992058 0.617702 0.236804 O\n0.132986 0.194527 0.244716 O\n0.536996 0.457420 0.747849 O\n0.389954 0.774584 0.770904 O\n0.890644 0.762328 0.771223 O\n0.694016 0.064843 0.775586 O\n0.043400 0.446313 0.801675 O\n0.199049 0.022831 0.809272 O\n0.059795 0.819246 0.985611 Si\n0.583622 0.837151 0.986073 Si\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Si"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.357844869679589,
"density_atomic": 0.11698425411837238,
"volume": 196.60765607589448,
"volume_molar": 5.147821649490026,
"formula_full": "Li8 Mn2 Si2 O11",
"formula_reduced": "Li8Mn2Si2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -2.35150409039522,
"spacegroup": 1
},
{
"id": "oqmd-694372",
"created_at": "2022-09-04T15:18:01.729126Z",
"updated_at": "2022-09-04T15:18:01.729159Z",
"structure_string": "Li8 Zr2 Mn2 O11\n1.0\n-5.219697 -9.014428 -0.046974\n-2.611288 4.508269 -0.027392\n1.724444 0.000954 -4.831894\nLi Mn O Zr\n8 2 11 2\ndirect\n0.746022 0.498755 0.008555 Li\n0.202510 0.754208 0.495259 Li\n0.817059 0.298076 0.496591 Li\n0.356464 0.354580 0.506785 Li\n0.669188 0.641688 0.515889 Li\n0.506891 0.033585 0.516803 Li\n0.976117 0.970559 0.518119 Li\n0.256628 0.488563 0.935206 Li\n0.906559 0.151454 0.001874 Mn\n0.418189 0.183168 0.003381 Mn\n0.444989 0.557275 0.225326 O\n0.292424 0.955796 0.232175 O\n0.802184 0.934248 0.240918 O\n0.976517 0.556036 0.246077 O\n0.628284 0.251000 0.263897 O\n0.192890 0.072930 0.734363 O\n0.706882 0.071697 0.754100 O\n0.379116 0.787316 0.758168 O\n0.032450 0.373251 0.768308 O\n0.534167 0.416244 0.776473 O\n0.882906 0.776964 0.794017 O\n0.583229 0.851394 0.009471 Zr\n0.079768 0.782888 0.960353 Zr\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Zr"
],
"chemical_system": "Li-Mn-O-Zr",
"density": 3.8113001797640718,
"density_atomic": 0.10077404348540626,
"volume": 228.23337443367328,
"volume_molar": 5.975884812910286,
"formula_full": "Li8 Zr2 Mn2 O11",
"formula_reduced": "Li8Zr2Mn2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -2.43796861561261,
"spacegroup": 1
},
{
"id": "oqmd-694456",
"created_at": "2022-09-04T15:18:01.760145Z",
"updated_at": "2022-09-04T15:18:01.760183Z",
"structure_string": "Pt4 O11\n1.0\n-5.242139 -8.691364 0.005562\n-2.698316 4.392366 0.044255\n1.846225 -0.036182 -4.304537\nO Pt\n11 4\ndirect\n0.995014 0.541302 0.224872 O\n0.799429 0.942925 0.229966 O\n0.289267 0.005835 0.268260 O\n0.479976 0.636344 0.268710 O\n0.610557 0.245992 0.270520 O\n0.891380 0.739861 0.697513 O\n0.028139 0.369317 0.734332 O\n0.701186 0.022235 0.744775 O\n0.513988 0.428314 0.767242 O\n0.390356 0.817437 0.774354 O\n0.201706 0.076067 0.781489 O\n0.585938 0.858736 0.015020 Pt\n0.417849 0.210348 0.027997 Pt\n0.913380 0.111956 0.964255 Pt\n0.079436 0.788534 0.973014 Pt\n",
"nsites": 15,
"nelements": 2,
"elements": [
"O",
"Pt"
],
"chemical_system": "O-Pt",
"density": 7.967968512683202,
"density_atomic": 0.07526312791054275,
"volume": 199.30077870041356,
"volume_molar": 8.001448952743337,
"formula_full": "Pt4 O11",
"formula_reduced": "Pt4O11",
"formula_anonymous": "A4B11",
"formation_energy": -0.274937420311087,
"spacegroup": 1
},
{
"id": "oqmd-694346",
"created_at": "2022-09-04T15:18:01.792434Z",
"updated_at": "2022-09-04T15:18:01.792464Z",
"structure_string": "Li8 Mn2 Os2 O11\n1.0\n-4.887167 -8.804790 0.008432\n-2.605966 4.494499 -0.030908\n1.688776 -0.011596 -4.788029\nLi Mn O Os\n8 2 11 2\ndirect\n0.331040 0.370063 0.493575 Li\n0.668740 0.654558 0.493938 Li\n0.998149 0.001002 0.497306 Li\n0.831392 0.333664 0.509322 Li\n0.518972 0.012142 0.520421 Li\n0.163089 0.626232 0.530630 Li\n0.241859 0.470304 0.977423 Li\n0.744059 0.499578 0.990539 Li\n0.403017 0.158825 0.992433 Mn\n0.919144 0.159050 0.997376 Mn\n0.116811 0.234357 0.233430 O\n0.605942 0.216746 0.234075 O\n0.785362 0.922556 0.235587 O\n0.458223 0.598839 0.239496 O\n0.998219 0.630111 0.262722 O\n0.888268 0.750707 0.738161 O\n0.380078 0.754981 0.752568 O\n0.205414 0.067518 0.757883 O\n0.538228 0.439401 0.760703 O\n0.039262 0.421898 0.774534 O\n0.712256 0.084511 0.777068 O\n0.084502 0.833364 0.004650 Os\n0.578367 0.830721 0.999820 Os\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"Os"
],
"chemical_system": "Li-Mn-O-Os",
"density": 5.5641021362056104,
"density_atomic": 0.10676339237167277,
"volume": 215.4296476448656,
"volume_molar": 5.640642008672101,
"formula_full": "Li8 Mn2 Os2 O11",
"formula_reduced": "Li8Mn2Os2O11",
"formula_anonymous": "A2B2C8D11",
"formation_energy": -1.82252918517783,
"spacegroup": 1
}
]
}