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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=spacegroup&page=133",
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"results": [
{
"id": "mp-776277",
"created_at": "2022-09-04T14:40:18.919677Z",
"structure_string": "Li12 Mn6 P16 O58\n1.0\n9.727401 0.000000 0.000000\n-4.845783 -8.442503 0.000000\n-0.005945 0.000332 -13.920226\nLi Mn P O\n12 6 16 58\ndirect\n0.988736 0.031214 0.491273 Li\n0.335445 0.101838 0.437898 Li\n0.775331 0.098053 0.941791 Li\n0.762763 0.664921 0.437074 Li\n0.092802 0.316428 0.062491 Li\n0.907379 0.678124 0.940750 Li\n0.234343 0.337899 0.558326 Li\n0.098121 0.763773 0.558747 Li\n0.331664 0.664111 0.885157 Li\n0.225003 0.915255 0.062988 Li\n0.682012 0.773737 0.063969 Li\n0.664701 0.904650 0.558779 Li\n0.434844 0.001343 0.250390 Mn\n0.567214 0.000382 0.749250 Mn\n0.431511 0.431588 0.750673 Mn\n0.564710 0.563206 0.248797 Mn\n0.998718 0.431912 0.252305 Mn\n0.000588 0.565424 0.747606 Mn\n0.318282 0.088671 0.659866 P\n0.319891 0.230990 0.158777 P\n0.768119 0.090376 0.160710 P\n0.666867 0.334382 0.869703 P\n0.668075 0.333858 0.370029 P\n0.913484 0.226198 0.659117 P\n0.092196 0.322643 0.842476 P\n0.768546 0.679797 0.658593 P\n0.228439 0.318299 0.341078 P\n0.909515 0.675750 0.159277 P\n0.089128 0.770798 0.340799 P\n0.332301 0.666450 0.128588 P\n0.333970 0.666843 0.626910 P\n0.231111 0.908531 0.842525 P\n0.677501 0.768059 0.841447 P\n0.682449 0.908867 0.341872 P\n0.210730 0.999851 0.751870 O\n0.238787 0.988817 0.934273 O\n0.337422 0.080843 0.159469 O\n0.212644 0.204195 0.254146 O\n0.224828 0.231114 0.433171 O\n0.334896 0.255251 0.659688 O\n0.479443 0.097899 0.672035 O\n0.508618 0.185465 0.335360 O\n0.620696 0.106310 0.176760 O\n0.770779 0.983227 0.433595 O\n0.792130 0.999917 0.250570 O\n0.744173 0.079809 0.659351 O\n0.515731 0.328094 0.828746 O\n0.483580 0.378461 0.174680 O\n0.672670 0.183099 0.835333 O\n0.673855 0.338470 0.977446 O\n0.662731 0.338185 0.477785 O\n0.810788 0.322085 0.330407 O\n0.616720 0.521141 0.671798 O\n0.676820 0.491251 0.332322 O\n0.919555 0.254980 0.159819 O\n0.993290 0.206616 0.756285 O\n0.003175 0.251584 0.933763 O\n0.003446 0.212782 0.575404 O\n0.908048 0.380412 0.668379 O\n0.818413 0.488637 0.832579 O\n0.081909 0.337982 0.338886 O\n0.895416 0.514355 0.176686 O\n0.744561 0.663031 0.158622 O\n0.232287 0.235637 0.072696 O\n0.753258 0.754009 0.932009 O\n0.788989 0.788852 0.751253 O\n0.257207 0.338593 0.840754 O\n0.115906 0.491345 0.823290 O\n0.918656 0.663203 0.658674 O\n0.184650 0.510802 0.164990 O\n0.098239 0.619189 0.329031 O\n0.002771 0.773986 0.431034 O\n0.997503 0.754940 0.068498 O\n0.000076 0.791450 0.249152 O\n0.079687 0.741804 0.839361 O\n0.321185 0.508706 0.664783 O\n0.382312 0.477957 0.328857 O\n0.188440 0.680149 0.664242 O\n0.333074 0.667611 0.019811 O\n0.334240 0.667108 0.519124 O\n0.324947 0.814743 0.165463 O\n0.508837 0.625624 0.824103 O\n0.489257 0.674807 0.164499 O\n0.255696 0.919988 0.341069 O\n0.231361 0.003602 0.569166 O\n0.375959 0.884569 0.823513 O\n0.491866 0.812386 0.664562 O\n0.523709 0.904784 0.330150 O\n0.661768 0.740449 0.337663 O\n0.771619 0.768890 0.568771 O\n0.664901 0.920326 0.842591 O\n0.758080 0.002150 0.069468 O\n",
"nsites": 92,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 2.6675807848999815,
"density_atomic": 0.08047731862475352,
"volume": 1143.179240712206,
"volume_molar": 7.4830285885639425,
"formula_full": "Li12 Mn6 P16 O58",
"formula_reduced": "Li6Mn3P8O29",
"formula_anonymous": "A3B6C8D29",
"energy": -682.3827174200001,
"energy_per_atom": -7.417203450217392,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -632.52871742,
"band_gap": 0.6261999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 17.9989716,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:02.540000Z",
"spacegroup": 1
},
{
"id": "mp-772148",
"created_at": "2022-09-04T14:40:18.922543Z",
"structure_string": "Li4 Mn5 Nb3 O16\n1.0\n6.137945 0.000000 0.000000\n-3.036859 5.355294 0.000000\n-0.020028 -0.078137 9.963619\nLi Mn Nb O\n4 5 3 16\ndirect\n0.344342 0.675597 0.895143 Li\n0.002749 0.000251 0.004757 Li\n0.019630 0.006168 0.495388 Li\n0.674701 0.341159 0.376488 Li\n0.163352 0.829013 0.212354 Mn\n0.310168 0.654441 0.490830 Mn\n0.164847 0.334491 0.215766 Mn\n0.334548 0.167651 0.717868 Mn\n0.651375 0.324518 0.011111 Mn\n0.651213 0.829074 0.218700 Nb\n0.826811 0.659515 0.714932 Nb\n0.828275 0.167219 0.714806 Nb\n0.146178 0.835370 0.608158 O\n0.043186 0.527559 0.320903 O\n0.357539 0.698870 0.096291 O\n0.984317 0.968296 0.316092 O\n0.973638 0.987220 0.821128 O\n0.143588 0.307848 0.605033 O\n0.492315 0.970689 0.333178 O\n0.478617 0.513714 0.326872 O\n0.302420 0.146120 0.113133 O\n0.683469 0.841416 0.602945 O\n0.530489 0.493900 0.831169 O\n0.533825 0.041250 0.831371 O\n0.696808 0.349807 0.597241 O\n0.837802 0.683109 0.102616 O\n0.976637 0.487880 0.823967 O\n0.847158 0.158157 0.109596 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Nb",
"O"
],
"chemical_system": "Li-Mn-Nb-O",
"density": 4.24459342621321,
"density_atomic": 0.08549379756455226,
"volume": 327.50913864667837,
"volume_molar": 7.043950475416619,
"formula_full": "Li4 Mn5 Nb3 O16",
"formula_reduced": "Li4Mn5Nb3O16",
"formula_anonymous": "A3B4C5D16",
"energy": -231.28608033,
"energy_per_atom": -8.260217154642858,
"energy_above_hull": null,
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"energy_uncorrected": -211.95408033,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 22.000685,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.467000Z",
"spacegroup": 1
},
{
"id": "mp-787551",
"created_at": "2022-09-04T14:40:18.883303Z",
"structure_string": "Na10 Li2 V12 O36\n1.0\n10.346801 0.000000 0.000000\n-0.076433 11.188200 0.000000\n-2.830931 -1.802817 7.369206\nNa Li V O\n10 2 12 36\ndirect\n0.139496 0.054840 0.944698 Na\n0.442599 0.153721 0.846371 Na\n0.890924 0.179904 0.820519 Na\n0.472769 0.387861 0.612604 Na\n0.223028 0.513086 0.487576 Na\n0.526172 0.611852 0.388092 Na\n0.777285 0.486699 0.513602 Na\n0.109220 0.820000 0.179564 Na\n0.807666 0.722336 0.277697 Na\n0.557320 0.846404 0.152531 Na\n0.189829 0.280067 0.719902 Li\n0.856343 0.946944 0.053215 Li\n0.357607 0.737319 0.841013 V\n0.021610 0.823166 0.598736 V\n0.689049 0.489596 0.931775 V\n0.648247 0.847874 0.739084 V\n0.975629 0.592067 0.824951 V\n0.306716 0.928570 0.492967 V\n0.024376 0.403559 0.174930 V\n0.692101 0.073471 0.509050 V\n0.354495 0.153369 0.264165 V\n0.980591 0.180018 0.403083 V\n0.311599 0.511801 0.066250 V\n0.643642 0.256383 0.156800 V\n0.008863 0.786783 0.963639 O\n0.271782 0.876749 0.830380 O\n0.515819 0.861334 0.841518 O\n0.774831 0.880538 0.840575 O\n0.064936 0.453606 0.831385 O\n0.285243 0.313066 0.931638 O\n0.658882 0.301606 0.995776 O\n0.560129 0.457364 0.835588 O\n0.315138 0.538695 0.706418 O\n0.817741 0.467640 0.823315 O\n0.149479 0.801510 0.489661 O\n0.394471 0.791569 0.504484 O\n0.623698 0.646765 0.607555 O\n0.050203 0.028830 0.726197 O\n0.325024 0.966641 0.328909 O\n0.991928 0.635772 0.663286 O\n0.892758 0.790708 0.502224 O\n0.652679 0.879197 0.370888 O\n0.340741 0.123675 0.631263 O\n0.106783 0.210334 0.504482 O\n0.676174 0.033642 0.672867 O\n0.009782 0.368673 0.340440 O\n0.954225 0.981684 0.267910 O\n0.378688 0.355168 0.394855 O\n0.605546 0.211959 0.498119 O\n0.849822 0.196101 0.508359 O\n0.182260 0.526811 0.174003 O\n0.681877 0.450620 0.295231 O\n0.439910 0.541138 0.162874 O\n0.341733 0.702656 0.006077 O\n0.717105 0.695045 0.059518 O\n0.938860 0.543216 0.163804 O\n0.226100 0.122508 0.167554 O\n0.484965 0.135832 0.157581 O\n0.731718 0.116370 0.162411 O\n0.981797 0.205291 0.040038 O\n",
"nsites": 60,
"nelements": 4,
"elements": [
"Na",
"Li",
"V",
"O"
],
"chemical_system": "Li-Na-O-V",
"density": 2.785599910918138,
"density_atomic": 0.0703338248785226,
"volume": 853.0746067575492,
"volume_molar": 8.562225601126013,
"formula_full": "Na10 Li2 V12 O36",
"formula_reduced": "Na5LiV6O18",
"formula_anonymous": "AB5C6D18",
"energy": -336.16355069,
"energy_per_atom": -5.6027258448333335,
"energy_above_hull": null,
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"energy_uncorrected": -291.03155069,
"band_gap": 0.4948000000000001,
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"is_magnetic": true,
"total_magnetization": 0.0009275,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.261000Z",
"spacegroup": 1
},
{
"id": "mp-1177024",
"created_at": "2022-09-04T14:40:18.914287Z",
"structure_string": "Li6 Co5 O10\n1.0\n5.455648 0.000000 0.000000\n2.411918 5.785660 0.000000\n1.795994 0.839477 8.003500\nLi Co O\n6 5 10\ndirect\n0.542642 0.709676 0.724417 Li\n0.533028 0.574850 0.366562 Li\n0.537274 0.133901 0.549899 Li\n0.458998 0.663158 0.052640 Li\n0.456770 0.083849 0.871583 Li\n0.463362 0.236046 0.237960 Li\n0.999402 0.895719 0.801364 Co\n0.999030 0.698584 0.390276 Co\n0.995455 0.296559 0.595485 Co\n0.004008 0.505046 0.002529 Co\n0.003291 0.106415 0.208771 Co\n0.744945 0.751560 0.892650 O\n0.754558 0.995440 0.344714 O\n0.743709 0.593494 0.516352 O\n0.746403 0.144422 0.711621 O\n0.744977 0.397669 0.158468 O\n0.254824 0.640362 0.898648 O\n0.246001 0.811530 0.249463 O\n0.261729 0.415423 0.438574 O\n0.253048 0.029434 0.712532 O\n0.256533 0.216872 0.075509 O\n",
"nsites": 21,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 3.262266240125126,
"density_atomic": 0.08312661489311943,
"volume": 252.62667109686691,
"volume_molar": 7.244539871788363,
"formula_full": "Li6 Co5 O10",
"formula_reduced": "Li6(CoO2)5",
"formula_anonymous": "A5B6C10",
"energy": -130.64483583999998,
"energy_per_atom": -6.221182659047618,
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"band_gap": 0.1253999999999999,
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"updated_at": "2021-11-28T01:34:56.009000Z",
"spacegroup": 1
},
{
"id": "mp-777960",
"created_at": "2022-09-04T14:40:18.998156Z",
"structure_string": "Li32 Mn11 Cr5 O48\n1.0\n5.002918 0.000000 0.000000\n-2.489587 4.349845 0.000000\n-0.656909 -1.252301 38.392478\nLi Mn Cr O\n32 11 5 48\ndirect\n0.906041 0.083357 0.249932 Li\n0.500759 0.000426 0.999968 Li\n0.563854 0.060772 0.187491 Li\n0.625599 0.124982 0.375030 Li\n0.691592 0.190085 0.562511 Li\n0.750386 0.252636 0.749953 Li\n0.812374 0.312538 0.937496 Li\n0.211736 0.036349 0.124791 Li\n0.875699 0.374918 0.124915 Li\n0.339300 0.166488 0.500030 Li\n0.461979 0.287768 0.874975 Li\n0.936667 0.438278 0.312523 Li\n0.998778 0.497561 0.499922 Li\n0.593795 0.417699 0.250139 Li\n0.712661 0.536626 0.624943 Li\n0.037569 0.216050 0.625255 Li\n0.162405 0.339254 0.999886 Li\n0.836134 0.660638 0.000041 Li\n0.959657 0.783697 0.374916 Li\n0.289915 0.465914 0.375197 Li\n0.410751 0.587352 0.749867 Li\n0.062306 0.562459 0.687505 Li\n0.536869 0.714606 0.125011 Li\n0.661258 0.835501 0.499815 Li\n0.126589 0.627576 0.875086 Li\n0.786975 0.960240 0.875204 Li\n0.188869 0.685132 0.062472 Li\n0.250338 0.749268 0.250045 Li\n0.312351 0.812609 0.437483 Li\n0.374553 0.871766 0.625066 Li\n0.434280 0.934156 0.812500 Li\n0.089003 0.910787 0.749992 Li\n0.979565 0.145193 0.437495 Mn\n0.395549 0.229390 0.687486 Mn\n0.520153 0.354728 0.062480 Mn\n0.645547 0.479516 0.437490 Mn\n0.770641 0.604101 0.812502 Mn\n0.895446 0.729480 0.187514 Mn\n0.354155 0.521130 0.562498 Mn\n0.479499 0.645169 0.937503 Mn\n0.604438 0.770566 0.312500 Mn\n0.729541 0.895310 0.687497 Mn\n0.145533 0.979527 0.937499 Mn\n0.856986 0.017088 0.062512 Cr\n0.267690 0.107655 0.312480 Cr\n0.099840 0.265443 0.812458 Cr\n0.232076 0.391526 0.187529 Cr\n0.025386 0.859805 0.562552 Cr\n0.946728 0.086805 0.340517 O\n0.906460 0.047766 0.159175 O\n0.570481 0.069379 0.283991 O\n0.695256 0.194729 0.658918 O\n0.554997 0.056163 0.090960 O\n0.678570 0.178912 0.465991 O\n0.809639 0.307537 0.840919 O\n0.819518 0.320398 0.033949 O\n0.946080 0.445437 0.409052 O\n0.211704 0.072640 0.215504 O\n0.930678 0.431183 0.215999 O\n0.336720 0.195452 0.590470 O\n0.463518 0.320757 0.965446 O\n0.177100 0.038524 0.034504 O\n0.304280 0.161459 0.409499 O\n0.428391 0.289421 0.784505 O\n0.070612 0.212397 0.715489 O\n0.037303 0.184440 0.534270 O\n0.161123 0.303724 0.909525 O\n0.593328 0.451517 0.340775 O\n0.712698 0.570938 0.715367 O\n0.552642 0.413727 0.159557 O\n0.676637 0.535085 0.534391 O\n0.804331 0.660866 0.909605 O\n0.201943 0.344067 0.090838 O\n0.320806 0.464017 0.465468 O\n0.448846 0.590704 0.840638 O\n0.288515 0.427821 0.284559 O\n0.411864 0.553647 0.659511 O\n0.836867 0.697615 0.090370 O\n0.963945 0.821046 0.465512 O\n0.924311 0.782094 0.284315 O\n0.576717 0.718900 0.215792 O\n0.696015 0.835758 0.590492 O\n0.820804 0.963583 0.965558 O\n0.530843 0.673005 0.034202 O\n0.661516 0.803935 0.409586 O\n0.069859 0.575361 0.783580 O\n0.787443 0.929270 0.784548 O\n0.054775 0.549354 0.591413 O\n0.178951 0.679397 0.966008 O\n0.194464 0.695333 0.158948 O\n0.315706 0.818171 0.534103 O\n0.446464 0.945887 0.909063 O\n0.305278 0.804867 0.341061 O\n0.430008 0.930293 0.715975 O\n0.087745 0.941432 0.840722 O\n0.054431 0.912072 0.659416 O\n",
"nsites": 96,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Cr",
"O"
],
"chemical_system": "Cr-Li-Mn-O",
"density": 3.685573152354406,
"density_atomic": 0.11490208845500849,
"volume": 835.4939522060135,
"volume_molar": 5.241106441993049,
"formula_full": "Li32 Mn11 Cr5 O48",
"formula_reduced": "Li32Mn11Cr5O48",
"formula_anonymous": "A5B11C32D48",
"energy": -659.27395455,
"energy_per_atom": -6.8674370265624995,
"energy_above_hull": null,
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"energy_uncorrected": -597.95495455,
"band_gap": 1.0192,
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"updated_at": "2021-11-28T01:34:54.416000Z",
"spacegroup": 1
},
{
"id": "mp-1075025",
"created_at": "2022-09-04T14:40:19.110276Z",
"structure_string": "Mg6 Si8\n1.0\n5.352971 0.000000 0.000000\n1.309164 6.847476 0.000000\n2.315276 2.534157 6.982504\nMg Si\n6 8\ndirect\n0.055497 0.479980 0.221102 Mg\n0.541501 0.744416 0.116744 Mg\n0.323069 0.734558 0.523807 Mg\n0.056554 0.962030 0.887176 Mg\n0.911605 0.417412 0.634219 Mg\n0.697265 0.244058 0.129548 Mg\n0.891628 0.829211 0.328859 Si\n0.953357 0.597054 0.868989 Si\n0.540492 0.385611 0.447749 Si\n0.265950 0.136891 0.490548 Si\n0.211442 0.077301 0.204714 Si\n0.477480 0.193334 0.841666 Si\n0.422887 0.564886 0.880545 Si\n0.657832 0.879989 0.677723 Si\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.4039039859174167,
"density_atomic": 0.0547005172663154,
"volume": 255.9390788178379,
"volume_molar": 11.009293990183957,
"formula_full": "Mg6 Si8",
"formula_reduced": "Mg3Si4",
"formula_anonymous": "A3B4",
"energy": -50.7016088,
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{
"id": "mp-1278251",
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"structure_string": "Sr2 La2 Ti2 Mn2 O12\n1.0\n-2.854705 4.915033 0.000495\n0.039369 3.300213 9.087483\n2.760514 4.860932 0.044320\nSr La Ti Mn O\n2 2 2 2 12\ndirect\n0.867899 0.373979 0.876115 Sr\n0.386438 0.874988 0.374523 Sr\n0.633688 0.121093 0.625781 La\n0.113502 0.619194 0.127687 La\n0.488098 0.497980 0.506607 Ti\n0.012916 0.997631 0.995800 Ti\n0.250550 0.249543 0.250906 Mn\n0.750071 0.750213 0.749500 Mn\n0.961688 0.870792 0.838913 O\n0.400581 0.384530 0.314522 O\n0.404254 0.886679 0.912541 O\n0.834272 0.377824 0.435426 O\n0.839752 0.878206 0.376782 O\n0.310697 0.372459 0.875079 O\n0.097449 0.619165 0.569080 O\n0.667984 0.123689 0.041022 O\n0.672465 0.627101 0.126601 O\n0.206063 0.127502 0.621914 O\n0.522741 0.626280 0.683751 O\n0.078887 0.121150 0.197446 O\n",
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{
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"structure_string": "Ga50 N50\n1.0\n11.231575 0.566771 0.014541\n0.552065 12.410931 -0.310176\n0.025548 -0.301053 11.399489\nGa N\n50 50\ndirect\n0.066153 0.690940 0.631082 Ga\n0.291099 0.672098 0.352073 Ga\n0.018427 0.568920 0.055816 Ga\n0.831353 0.755604 0.579091 Ga\n0.167087 0.212531 0.179211 Ga\n0.519111 0.521874 0.768114 Ga\n0.423962 0.748660 0.816984 Ga\n0.128804 0.009448 0.099261 Ga\n0.455383 0.456143 0.510980 Ga\n0.933299 0.128695 0.215707 Ga\n0.222659 0.938500 0.833569 Ga\n0.212506 0.170273 0.875657 Ga\n0.775710 0.445709 0.903200 Ga\n0.879629 0.325961 0.069133 Ga\n0.088560 0.310389 0.381035 Ga\n0.514547 0.961722 0.815742 Ga\n0.892744 0.114797 0.492029 Ga\n0.548117 0.616170 0.034743 Ga\n0.615694 0.545953 0.399464 Ga\n0.839556 0.002354 0.657919 Ga\n0.021657 0.718228 0.315065 Ga\n0.562308 0.704426 0.272879 Ga\n0.936429 0.348826 0.625443 Ga\n0.584604 0.151508 0.958935 Ga\n0.421856 0.253081 0.286632 Ga\n0.546905 0.883827 0.067536 Ga\n0.143961 0.472298 0.212556 Ga\n0.887831 0.553470 0.463761 Ga\n0.376415 0.862334 0.568542 Ga\n0.833124 0.975732 0.984753 Ga\n0.949376 0.587463 0.778868 Ga\n0.682039 0.309305 0.618879 Ga\n0.991240 0.167352 0.731385 Ga\n0.151636 0.515802 0.489831 Ga\n0.400793 0.060414 0.061563 Ga\n0.986447 0.177436 0.956950 Ga\n0.652449 0.891788 0.631158 Ga\n0.673118 0.684756 0.857261 Ga\n0.306824 0.631747 0.605562 Ga\n0.808668 0.558194 0.186450 Ga\n0.820929 0.346164 0.358005 Ga\n0.791420 0.762613 0.108378 Ga\n0.021761 0.908114 0.753708 Ga\n0.426538 0.281623 0.734632 Ga\n0.343591 0.879082 0.296058 Ga\n0.248413 0.603133 0.919001 Ga\n0.071335 0.923078 0.299477 Ga\n0.547851 0.704850 0.554168 Ga\n0.745659 0.561312 0.634337 Ga\n0.963797 0.776335 0.903738 Ga\n0.269693 0.125838 0.524325 N\n0.578326 0.213483 0.807085 N\n0.603951 0.101436 0.263394 N\n0.960963 0.050949 0.350956 N\n0.953494 0.695607 0.470763 N\n0.069033 0.628809 0.909444 N\n0.785864 0.499855 0.338549 N\n0.357633 0.613364 0.777663 N\n0.696684 0.940721 0.402653 N\n0.249204 0.773644 0.003785 N\n0.603631 0.642281 0.705925 N\n0.532922 0.756421 0.945826 N\n0.240043 0.367800 0.449943 N\n0.841183 0.457195 0.741901 N\n0.136262 0.389265 0.786647 N\n0.346721 0.335058 0.459319 N\n0.742157 0.089047 0.893180 N\n0.511926 0.083229 0.555021 N\n0.005339 0.429651 0.496011 N\n0.675259 0.656862 0.143874 N\n0.392123 0.537531 0.201100 N\n0.353180 0.455097 0.197612 N\n0.389341 0.369988 0.938391 N\n0.924461 0.675523 0.176685 N\n0.168803 0.900500 0.505450 N\n0.246522 0.032329 0.971367 N\n0.622747 0.528874 0.904808 N\n0.487382 0.831414 0.214545 N\n0.098562 0.942475 0.567940 N\n0.605722 0.362085 0.221005 N\n0.546025 0.148736 0.503336 N\n0.956761 0.055251 0.057163 N\n0.728861 0.867625 0.346340 N\n0.860590 0.270269 0.218532 N\n0.336582 0.175117 0.174129 N\n0.148691 0.591238 0.335651 N\n0.224936 0.806079 0.097048 N\n0.602183 0.380537 0.125346 N\n0.676056 0.193206 0.744118 N\n0.877179 0.477576 0.046570 N\n0.724342 0.896358 0.063741 N\n0.172937 0.156351 0.538095 N\n0.679227 0.105097 0.198904 N\n0.212570 0.412266 0.731866 N\n0.808062 0.276922 0.506057 N\n0.532097 0.391224 0.656566 N\n0.370384 0.885655 0.752719 N\n0.763619 0.123287 0.787188 N\n0.312937 0.347876 0.993586 N\n0.835325 0.690060 0.870062 N\n",
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"elements": [
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],
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"formula_full": "Ga50 N50",
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},
{
"id": "mp-1233742",
"created_at": "2022-09-04T14:40:19.198701Z",
"structure_string": "Rb2 Mg1 Nb2 Te2 O12\n1.0\n-5.321603 0.110437 -5.392030\n5.410327 -5.407280 0.044052\n-5.257792 -5.269968 0.049565\nRb Mg Nb Te O\n2 1 2 2 12\ndirect\n0.802289 0.398414 0.385932 Rb\n0.341939 0.789415 0.560706 Rb\n0.056095 0.253706 0.801705 Mg\n0.472637 0.485077 0.969634 Nb\n0.500298 0.002036 0.015251 Nb\n0.009569 0.005508 0.493046 Te\n0.922758 0.856601 0.070572 Te\n0.799430 0.834773 0.380268 O\n0.539960 0.272511 0.897422 O\n0.182505 0.826671 0.973262 O\n0.167386 0.261488 0.263062 O\n0.311415 0.460983 0.837230 O\n0.229400 0.931370 0.308432 O\n0.215544 0.144160 0.595593 O\n0.439209 0.725861 0.074786 O\n0.743456 0.146789 0.075011 O\n0.821280 0.729772 0.712306 O\n0.674413 0.569432 0.141748 O\n0.797201 0.091147 0.684776 O\n",
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],
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{
"id": "mp-1176194",
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"structure_string": "Li9 Mn2 Co5 O16\n1.0\n3.015207 0.000000 0.000000\n-0.139272 5.060153 0.000000\n-1.117162 -0.837091 19.072864\nLi Mn Co O\n9 2 5 16\ndirect\n0.004263 0.622414 0.874157 Li\n0.507230 0.746056 0.749344 Li\n0.000095 0.874271 0.624630 Li\n0.491724 0.003139 0.499757 Li\n0.998107 0.125952 0.375928 Li\n0.501374 0.252791 0.250658 Li\n0.998934 0.376264 0.125219 Li\n0.499823 0.499753 0.000388 Li\n0.498402 0.375544 0.624059 Li\n0.989990 0.998129 0.000888 Mn\n0.502388 0.128606 0.872476 Mn\n0.010353 0.253188 0.742547 Co\n0.991734 0.498018 0.504189 Co\n0.500595 0.620685 0.375470 Co\n0.007489 0.752115 0.252194 Co\n0.504034 0.873133 0.128461 Co\n0.528342 0.828584 0.935179 O\n0.026145 0.968559 0.808739 O\n0.529298 0.073017 0.690828 O\n0.000596 0.217963 0.553741 O\n0.523803 0.336292 0.437160 O\n0.025994 0.461386 0.313512 O\n0.540454 0.583005 0.189802 O\n0.978156 0.708023 0.064960 O\n0.475807 0.421106 0.810693 O\n0.997665 0.532896 0.693342 O\n0.465757 0.677471 0.556613 O\n0.971741 0.777097 0.437550 O\n0.475504 0.912994 0.314001 O\n0.023759 0.037507 0.189654 O\n0.459630 0.166914 0.065762 O\n0.970820 0.297133 0.938095 O\n",
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],
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},
{
"id": "mp-1177220",
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"structure_string": "Li4 V3 Cu3 W2 O16\n1.0\n-5.915830 0.000000 0.000000\n2.945923 5.184105 0.000000\n-0.009526 -0.446404 -9.937575\nLi V Cu W O\n4 3 3 2 16\ndirect\n0.666297 0.333508 0.089059 Li\n0.995881 0.989572 0.010820 Li\n0.997236 0.994725 0.521215 Li\n0.342116 0.687434 0.590130 Li\n0.825984 0.651083 0.772505 V\n0.658083 0.821260 0.284036 V\n0.163454 0.815680 0.280128 V\n0.819955 0.163201 0.792655 Cu\n0.342390 0.162372 0.792999 Cu\n0.169427 0.338466 0.291976 Cu\n0.664853 0.330424 0.511126 W\n0.330014 0.656107 0.010311 W\n0.819412 0.155401 0.415146 O\n0.531176 0.061513 0.641633 O\n0.680659 0.362953 0.880974 O\n0.995153 0.990005 0.713935 O\n0.010346 0.994061 0.201741 O\n0.338336 0.158413 0.415790 O\n0.974761 0.522297 0.636582 O\n0.548254 0.524151 0.635400 O\n0.161951 0.326541 0.928715 O\n0.830925 0.648793 0.397724 O\n0.498307 0.536405 0.149029 O\n0.034887 0.533243 0.151024 O\n0.330375 0.685578 0.388447 O\n0.643505 0.800348 0.915216 O\n0.471281 0.959121 0.157487 O\n0.155281 0.797344 0.916359 O\n",
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"formula_full": "Li4 V3 Cu3 W2 O16",
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},
{
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"structure_string": "Li10 Fe10 O24\n1.0\n5.096358 0.000000 0.000000\n-2.512955 4.438451 0.000000\n-1.123140 -1.565202 19.616649\nLi Fe O\n10 10 24\ndirect\n0.008543 0.511886 0.502258 Li\n0.350763 0.163534 0.502187 Li\n0.377743 0.873681 0.625064 Li\n0.095049 0.906056 0.747365 Li\n0.503452 0.016204 0.002468 Li\n0.745826 0.244404 0.747703 Li\n0.872875 0.375798 0.125067 Li\n0.587282 0.401308 0.247558 Li\n0.239926 0.737652 0.248105 Li\n0.155204 0.343514 0.002612 Li\n0.461044 0.288870 0.875182 Fe\n0.127338 0.624183 0.874935 Fe\n0.792762 0.959132 0.874981 Fe\n0.708768 0.541810 0.624971 Fe\n0.045171 0.205609 0.625104 Fe\n0.959831 0.791701 0.374833 Fe\n0.628306 0.122866 0.374977 Fe\n0.290120 0.461532 0.374998 Fe\n0.207206 0.045994 0.124932 Fe\n0.554391 0.717847 0.124788 Fe\n0.796489 0.605571 0.822233 O\n0.457209 0.642139 0.928105 O\n0.811769 0.298680 0.932160 O\n0.340512 0.482899 0.572846 O\n0.297528 0.107605 0.320380 O\n0.411705 0.259161 0.678183 O\n0.016733 0.541661 0.679449 O\n0.974661 0.149234 0.428197 O\n0.298226 0.809197 0.432580 O\n0.442900 0.949596 0.817878 O\n0.098582 0.268326 0.820030 O\n0.857777 0.010598 0.073539 O\n0.708885 0.236021 0.570668 O\n0.894033 0.746504 0.175651 O\n0.990336 0.841770 0.572252 O\n0.155324 0.978692 0.929553 O\n0.509020 0.041055 0.180411 O\n0.769286 0.909086 0.677160 O\n0.941003 0.454807 0.317354 O\n0.601341 0.778004 0.321761 O\n0.233206 0.722397 0.071478 O\n0.469697 0.326094 0.069545 O\n0.644856 0.452745 0.429402 O\n0.269566 0.406517 0.178626 O\n",
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"formula_full": "Li10 Fe10 O24",
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}
]
}