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{
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"results": [
{
"id": "mp-1184199",
"created_at": "2022-09-04T14:47:20.395076Z",
"structure_string": "Eu2 Ag1 Pb1\n1.0\n0.000000 3.927276 3.927276\n3.927276 0.000000 3.927276\n3.927276 3.927276 0.000000\nEu Ag Pb\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Eu\n0.250000 0.250000 0.250000 Eu\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Pb\n",
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"formula_full": "Eu2 Ag1 Pb1",
"formula_reduced": "Eu2AgPb",
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"spacegroup": 225
},
{
"id": "mp-675046",
"created_at": "2022-09-04T14:47:20.401155Z",
"structure_string": "Rb28 Mg9 In51\n1.0\n10.308200 0.060623 0.000000\n-5.101974 8.925809 0.000000\n0.000000 0.000000 35.839962\nRb Mg In\n28 9 51\ndirect\n0.000357 0.604801 0.408717 Rb\n0.999767 0.604929 0.908947 Rb\n0.249090 0.997513 0.342468 Rb\n0.247697 0.000193 0.842557 Rb\n0.999958 0.246945 0.157953 Rb\n0.996797 0.245136 0.658201 Rb\n0.332655 0.666078 0.999943 Rb\n0.332655 0.666078 0.500057 Rb\n0.605110 0.000696 0.909527 Rb\n0.395532 0.395750 0.090700 Rb\n0.395532 0.395750 0.409300 Rb\n0.394896 0.396118 0.909649 Rb\n0.394896 0.396118 0.590351 Rb\n0.249090 0.997513 0.157532 Rb\n0.247697 0.000193 0.657443 Rb\n0.750159 0.747698 0.342608 Rb\n0.750159 0.747698 0.157392 Rb\n0.749707 0.752804 0.657742 Rb\n0.749707 0.752804 0.842258 Rb\n0.666500 0.333003 0.000062 Rb\n0.666500 0.333003 0.499938 Rb\n0.605216 0.000766 0.090907 Rb\n0.605216 0.000766 0.409093 Rb\n0.605110 0.000696 0.590473 Rb\n0.000357 0.604801 0.091283 Rb\n0.999767 0.604929 0.591053 Rb\n0.999958 0.246945 0.342047 Rb\n0.996797 0.245136 0.841799 Rb\n0.298753 0.820373 0.750000 Mg\n0.179847 0.478126 0.250000 Mg\n0.178997 0.471614 0.750000 Mg\n0.528743 0.709751 0.250000 Mg\n0.471975 0.181780 0.250000 Mg\n0.481630 0.181674 0.750000 Mg\n0.708530 0.530766 0.750000 Mg\n0.999098 0.826268 0.250000 Mg\n0.821492 0.297949 0.250000 Mg\n0.000025 0.587166 0.301473 In\n0.004776 0.593052 0.800753 In\n0.999179 0.280215 0.544721 In\n0.999179 0.280215 0.955279 In\n0.297795 0.823138 0.250000 In\n0.335294 0.667785 0.170954 In\n0.331929 0.662880 0.670076 In\n0.999473 0.999514 0.071570 In\n0.335294 0.667785 0.329046 In\n0.999473 0.999514 0.428430 In\n0.999808 0.999625 0.571690 In\n0.331929 0.662880 0.829924 In\n0.170323 0.169739 0.250000 In\n0.174746 0.170468 0.750000 In\n0.203470 0.204120 -0.000026 In\n0.203470 0.204120 0.500026 In\n0.516400 0.694582 0.750000 In\n0.408570 0.413415 0.300152 In\n0.414187 0.407840 0.801058 In\n0.408570 0.413415 0.199848 In\n0.414187 0.407840 0.698942 In\n0.279196 0.998357 0.044262 In\n0.279196 0.998357 0.455738 In\n0.278938 0.998395 0.544356 In\n0.278938 0.998395 0.955644 In\n0.721447 0.720655 0.044052 In\n0.721447 0.720655 0.455948 In\n0.721653 0.720755 0.955589 In\n0.721653 0.720755 0.544411 In\n0.702034 0.524646 0.250000 In\n0.664884 0.332718 0.171136 In\n0.669975 0.336637 0.670190 In\n0.999808 0.999625 0.928310 In\n0.664884 0.332718 0.328864 In\n0.669975 0.336637 0.829810 In\n0.003513 0.831767 0.750000 In\n0.591578 0.004661 0.300158 In\n0.591578 0.004661 0.199842 In\n0.582296 0.998531 0.698142 In\n0.582296 0.998531 0.801858 In\n0.001058 0.793629 0.500050 In\n0.001058 0.793629 -0.000050 In\n0.823392 0.304181 0.750000 In\n0.000025 0.587166 0.198527 In\n0.004776 0.593052 0.699247 In\n0.795862 0.001341 0.999933 In\n0.795862 0.001341 0.500067 In\n0.829364 0.998107 0.250000 In\n0.821411 0.997307 0.750000 In\n0.998939 0.280156 0.044094 In\n0.998939 0.280156 0.455906 In\n",
"nsites": 88,
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"elements": [
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"In"
],
"chemical_system": "In-Mg-Rb",
"density": 4.249638742287178,
"density_atomic": 0.026596668045136548,
"volume": 3308.6851274248856,
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"formula_full": "Rb28 Mg9 In51",
"formula_reduced": "Rb28(Mg3In17)3",
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"energy": -193.93038428,
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"updated_at": "2021-11-28T01:38:03.293000Z",
"spacegroup": 6
},
{
"id": "mp-1176003",
"created_at": "2022-09-04T14:47:20.402751Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n5.123546 0.000000 0.000000\n-0.070703 5.895791 0.000000\n-1.869519 -2.596218 9.551839\nLi Mn Co O\n9 2 5 16\ndirect\n0.501634 0.747891 0.005317 Li\n0.255609 0.365910 0.741370 Li\n0.495975 0.251164 0.001383 Li\n0.252735 0.875031 0.745965 Li\n0.743520 0.131745 0.260212 Li\n0.747065 0.635842 0.257155 Li\n0.994299 0.490111 0.495568 Li\n0.010978 0.007634 0.496694 Li\n0.497836 0.254716 0.497402 Li\n0.001582 0.996321 0.000119 Mn\n0.753688 0.623624 0.748283 Mn\n0.245928 0.880296 0.253514 Co\n0.001018 0.493102 0.998853 Co\n0.737111 0.123209 0.739099 Co\n0.503827 0.745662 0.493751 Co\n0.250900 0.372246 0.259245 Co\n0.349147 0.049054 0.125466 O\n0.101123 0.697746 0.886228 O\n0.338544 0.542808 0.119382 O\n0.106059 0.166264 0.877373 O\n0.607649 0.452979 0.371742 O\n0.592332 0.927578 0.371545 O\n0.864625 0.807959 0.632639 O\n0.874696 0.342289 0.642256 O\n0.656728 0.443845 0.873442 O\n0.399530 0.064783 0.633055 O\n0.658765 0.918515 0.874092 O\n0.411062 0.581828 0.632545 O\n0.900208 0.822906 0.125409 O\n0.889092 0.288319 0.104754 O\n0.121835 0.201581 0.367439 O\n0.134900 0.697041 0.368704 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.160912293915851,
"density_atomic": 0.11090478012300069,
"volume": 288.5358048995715,
"volume_molar": 5.430010098140992,
"formula_full": "Li9 Mn2 Co5 O16",
"formula_reduced": "Li9Mn2Co5O16",
"formula_anonymous": "A2B5C9D16",
"energy": -208.46234506,
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"updated_at": "2021-11-28T01:38:07.361000Z",
"spacegroup": 1
},
{
"id": "mp-1194884",
"created_at": "2022-09-04T14:47:20.421392Z",
"structure_string": "H84 C96 Xe2 Cl6 O12\n1.0\n12.197653 0.000000 0.000000\n-3.712278 12.591103 0.000000\n-4.142254 -4.410657 15.048144\nH C Xe Cl O\n84 96 2 6 12\ndirect\n0.403740 0.474468 0.877309 H\n0.596260 0.525532 0.122691 H\n0.379607 0.417098 0.966220 H\n0.620393 0.582902 0.033780 H\n0.532360 0.477759 0.715583 H\n0.467640 0.522241 0.284417 H\n0.328461 0.847194 0.577543 H\n0.671539 0.152806 0.422457 H\n0.646025 0.964110 0.990317 H\n0.353975 0.035890 0.009683 H\n0.190401 0.353541 0.780879 H\n0.809599 0.646459 0.219121 H\n0.167307 0.301428 0.871687 H\n0.832693 0.698572 0.128313 H\n0.873300 0.460388 0.510181 H\n0.126700 0.539612 0.489819 H\n0.935432 0.376328 0.449616 H\n0.064568 0.623672 0.550384 H\n0.823706 0.689660 0.953393 H\n0.176294 0.310340 0.046607 H\n0.408074 0.572873 0.446351 H\n0.591926 0.427127 0.553649 H\n0.563681 0.156825 0.811584 H\n0.436319 0.843175 0.188416 H\n0.690970 0.787324 0.989352 H\n0.309030 0.212676 0.010648 H\n0.393212 0.491416 0.568541 H\n0.606788 0.508584 0.431459 H\n0.383057 0.998418 0.717747 H\n0.616943 0.001582 0.282253 H\n0.369928 0.720600 0.872590 H\n0.630072 0.279400 0.127410 H\n0.493457 0.790556 0.971016 H\n0.506543 0.209444 0.028984 H\n0.304517 0.590888 0.758558 H\n0.695483 0.409112 0.241442 H\n0.335749 0.483426 0.696603 H\n0.664251 0.516574 0.303397 H\n0.267585 0.729810 0.756993 H\n0.732415 0.270190 0.243007 H\n0.242163 0.821201 0.694294 H\n0.757837 0.178799 0.305706 H\n0.080564 0.853140 0.879108 H\n0.919436 0.146860 0.120892 H\n0.755701 0.720281 0.454573 H\n0.244299 0.279719 0.545427 H\n0.852559 0.202687 0.712156 H\n0.147441 0.797313 0.287844 H\n0.847062 0.548163 0.679364 H\n0.152938 0.451837 0.320636 H\n0.569630 0.954964 0.453819 H\n0.430370 0.045036 0.546181 H\n0.947170 0.155643 0.973378 H\n0.052830 0.844357 0.026622 H\n0.862865 0.642714 0.564438 H\n0.137135 0.357286 0.435562 H\n0.756967 0.100154 0.553268 H\n0.243033 0.899846 0.446732 H\n0.074839 0.055355 0.931354 H\n0.925161 0.944645 0.068646 H\n0.974372 0.791471 0.521156 H\n0.025628 0.208529 0.478844 H\n0.054926 0.925767 0.593230 H\n0.945074 0.074233 0.406770 H\n0.055937 0.077876 0.635741 H\n0.944063 0.922124 0.364259 H\n0.970996 0.165292 0.620791 H\n0.029004 0.834708 0.379209 H\n0.142679 0.012378 0.723075 H\n0.857321 0.987622 0.276925 H\n0.179999 0.006541 0.833786 H\n0.820001 0.993459 0.166214 H\n0.891905 0.537379 0.914757 H\n0.108095 0.462621 0.085243 H\n0.902575 0.482487 0.806996 H\n0.097425 0.517513 0.193004 H\n0.427785 0.805941 0.338098 H\n0.572215 0.194059 0.661902 H\n0.371706 0.660553 0.331827 H\n0.628294 0.339447 0.668173 H\n0.860360 0.294600 0.994845 H\n0.139640 0.705400 0.005155 H\n0.715208 0.292642 0.927971 H\n0.284792 0.707358 0.072029 H\n0.493576 0.608423 0.792357 C\n0.506424 0.391577 0.207643 C\n0.341171 0.725815 0.649292 C\n0.658829 0.274185 0.350708 C\n0.490825 0.875755 0.871559 C\n0.509175 0.124245 0.128441 C\n0.353208 0.402469 0.894071 C\n0.646792 0.597531 0.105929 C\n0.567599 0.548635 0.774541 C\n0.432401 0.451365 0.225459 C\n0.345875 0.770066 0.577698 C\n0.654125 0.229934 0.422302 C\n0.590003 0.968580 0.927631 C\n0.409997 0.031420 0.072369 C\n0.217978 0.371836 0.853328 C\n0.782022 0.628164 0.146672 C\n0.686969 0.577914 0.830022 C\n0.313031 0.422086 0.169978 C\n0.375085 0.719614 0.506326 C\n0.624915 0.280386 0.493674 C\n0.621102 0.068124 0.904994 C\n0.378898 0.931876 0.095006 C\n0.956979 0.448977 0.504772 C\n0.043021 0.551023 0.495228 C\n0.731318 0.663943 0.908473 C\n0.268682 0.336057 0.091527 C\n0.388604 0.616642 0.501796 C\n0.611396 0.383358 0.498204 C\n0.544319 0.079663 0.829949 C\n0.455681 0.920337 0.170051 C\n0.655995 0.720628 0.927565 C\n0.344005 0.279372 0.072435 C\n0.381542 0.571534 0.572401 C\n0.618458 0.428466 0.427599 C\n0.442886 0.988531 0.776146 C\n0.557114 0.011469 0.223854 C\n0.538367 0.697216 0.870832 C\n0.461633 0.302784 0.129168 C\n0.362796 0.625354 0.648174 C\n0.637204 0.374646 0.351826 C\n0.416603 0.884770 0.792640 C\n0.583397 0.115230 0.207360 C\n0.467307 0.768385 0.898109 C\n0.532693 0.231615 0.101891 C\n0.367535 0.573740 0.724894 C\n0.632465 0.426260 0.275106 C\n0.310828 0.788068 0.724607 C\n0.689172 0.211932 0.275393 C\n0.033863 0.864595 0.743890 C\n0.966137 0.135405 0.256110 C\n0.862204 0.885660 0.540972 C\n0.137796 0.114340 0.459028 C\n0.967787 0.104923 0.733266 C\n0.032213 0.895077 0.266734 C\n0.029807 0.808714 0.809262 C\n0.970193 0.191286 0.190738 C\n0.756552 0.803997 0.479519 C\n0.243448 0.196003 0.520481 C\n0.899469 0.166812 0.759109 C\n0.100531 0.833188 0.240891 C\n0.960980 0.696219 0.787877 C\n0.039020 0.303781 0.212123 C\n0.649216 0.825653 0.450465 C\n0.350784 0.174347 0.549535 C\n0.886512 0.181928 0.843415 C\n0.113488 0.818072 0.156585 C\n0.901601 0.635651 0.698839 C\n0.098399 0.364349 0.301161 C\n0.650531 0.933959 0.475566 C\n0.349469 0.066041 0.524434 C\n0.952848 0.143759 0.906565 C\n0.047152 0.856241 0.093435 C\n0.909962 0.690428 0.633967 C\n0.090038 0.309572 0.366033 C\n0.757350 0.016053 0.533515 C\n0.242650 0.983947 0.466485 C\n0.023851 0.085135 0.881492 C\n0.976149 0.914865 0.118508 C\n0.972800 0.804097 0.653545 C\n0.027200 0.195903 0.346455 C\n0.862769 0.994358 0.569744 C\n0.137231 0.005642 0.430256 C\n0.030143 0.060748 0.795171 C\n0.969857 0.939252 0.204829 C\n0.972244 0.853853 0.575930 C\n0.027756 0.146147 0.424070 C\n0.970746 0.088410 0.638530 C\n0.029254 0.911590 0.361470 C\n0.103357 0.988850 0.773475 C\n0.896643 0.011150 0.226525 C\n0.877597 0.544455 0.846558 C\n0.122403 0.455545 0.153442 C\n0.431040 0.743714 0.374687 C\n0.568960 0.256286 0.625313 C\n0.778366 0.247041 0.937435 C\n0.221634 0.752959 0.062565 C\n0.695018 0.846591 0.719116 Xe\n0.304982 0.153409 0.280884 Xe\n0.394784 0.288122 0.850535 Cl\n0.605216 0.711878 0.149465 Cl\n0.176101 0.487840 0.893354 Cl\n0.823899 0.512160 0.106646 Cl\n0.028952 0.420439 0.604940 Cl\n0.971048 0.579561 0.395060 Cl\n0.753072 0.518358 0.799717 O\n0.246928 0.481642 0.200283 O\n0.389978 0.779529 0.445864 O\n0.610022 0.220471 0.554136 O\n0.729769 0.148579 0.960181 O\n0.270231 0.851421 0.039819 O\n0.954953 0.654211 0.859459 O\n0.045047 0.345789 0.140541 O\n0.547440 0.734245 0.399810 O\n0.452560 0.265755 0.600190 O\n0.804692 0.232698 0.856156 O\n0.195308 0.767302 0.143844 O\n",
"nsites": 200,
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},
{
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"updated_at": "2021-11-28T01:38:05.219000Z",
"spacegroup": 70
}
]
}