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{
"id": "mp-1422819",
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{
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},
{
"id": "mp-1224186",
"created_at": "2022-09-04T14:47:06.655743Z",
"structure_string": "Ho4 V2 Fe2 O12\n1.0\n5.621675 0.000000 0.000000\n0.000000 5.270909 0.000000\n0.000000 5.280393 7.571561\nHo V Fe O\n4 2 2 12\ndirect\n0.567579 0.731953 0.749139 Ho\n0.067579 0.268047 0.750861 Ho\n0.432421 0.268047 0.250861 Ho\n0.932421 0.731953 0.249139 Ho\n0.000000 0.500000 0.000000 V\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.955997 0.863899 0.748671 O\n0.455997 0.136101 0.751329 O\n0.044003 0.136101 0.251329 O\n0.544003 0.863899 0.248671 O\n0.802059 0.247496 0.943338 O\n0.302059 0.752504 0.556662 O\n0.189501 0.359794 0.443921 O\n0.689501 0.640206 0.056079 O\n0.197941 0.752504 0.056662 O\n0.697941 0.247496 0.443338 O\n0.810499 0.640206 0.556079 O\n0.310499 0.359794 0.943921 O\n",
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"elements": [
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"chemical_system": "Fe-Ho-O-V",
"density": 7.884589344875999,
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"formula_full": "Ho4 V2 Fe2 O12",
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"updated_at": "2021-11-28T01:37:53.086000Z",
"spacegroup": 14
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{
"id": "mp-1099665",
"created_at": "2022-09-04T14:47:15.391283Z",
"structure_string": "Sr16 Ca16 Fe8 Co24 O80\n1.0\n-0.013638 -0.005172 10.787133\n11.237521 -0.001924 -0.014183\n-5.614441 15.635666 -5.393327\nSr Ca Fe Co O\n16 16 8 24 80\ndirect\n0.303999 0.565973 0.609251 Sr\n0.806617 0.062190 0.608888 Sr\n0.809732 0.560078 0.610428 Sr\n0.192884 0.438961 0.382358 Sr\n0.202186 0.437762 0.895715 Sr\n0.693802 0.431396 0.383554 Sr\n0.695601 0.931988 0.382200 Sr\n0.699304 0.941896 0.893604 Sr\n0.054164 0.293968 0.609983 Sr\n0.061951 0.797540 0.609406 Sr\n0.558578 0.296571 0.610767 Sr\n0.554529 0.798752 0.610311 Sr\n0.444332 0.202194 0.383456 Sr\n0.452848 0.205745 0.893166 Sr\n0.940964 0.199051 0.384489 Sr\n0.945510 0.202120 0.894203 Sr\n0.301277 0.067711 0.107225 Ca\n0.303524 0.065401 0.607247 Ca\n0.309335 0.565541 0.111336 Ca\n0.804986 0.069837 0.109016 Ca\n0.803482 0.566582 0.111072 Ca\n0.192884 0.928852 0.387881 Ca\n0.196014 0.932118 0.897136 Ca\n0.696380 0.433198 0.898035 Ca\n0.054757 0.289115 0.108402 Ca\n0.056350 0.792498 0.109859 Ca\n0.551891 0.296004 0.107525 Ca\n0.552502 0.788892 0.107608 Ca\n0.440047 0.702430 0.385825 Ca\n0.443010 0.712848 0.895691 Ca\n0.951609 0.705421 0.387519 Ca\n0.950196 0.715654 0.897408 Ca\n0.115103 0.090855 0.756746 Fe\n0.109227 0.596140 0.754427 Fe\n0.609715 0.593487 0.755999 Fe\n0.360561 0.411331 0.752472 Fe\n0.352234 0.904253 0.246435 Fe\n0.358944 0.910868 0.754844 Fe\n0.857818 0.415354 0.759148 Fe\n0.861437 0.907467 0.751627 Fe\n0.009206 0.001924 0.006344 Co\n0.003940 0.997338 0.496049 Co\n0.005660 0.499950 0.004595 Co\n0.001477 0.498702 0.495936 Co\n0.508941 0.004140 0.006134 Co\n0.499242 0.994547 0.492391 Co\n0.508389 0.503099 0.004037 Co\n0.504972 0.501599 0.501051 Co\n0.256745 0.251258 0.004138 Co\n0.251965 0.247684 0.496940 Co\n0.259665 0.752420 0.007217 Co\n0.254716 0.750751 0.497561 Co\n0.761105 0.258299 0.013645 Co\n0.751731 0.247362 0.498443 Co\n0.758376 0.751303 0.002592 Co\n0.753036 0.745477 0.495328 Co\n0.106561 0.089372 0.247002 Co\n0.105588 0.595417 0.243347 Co\n0.604785 0.087672 0.241750 Co\n0.605222 0.098134 0.748501 Co\n0.608369 0.593287 0.246993 Co\n0.353410 0.406819 0.242199 Co\n0.856402 0.409615 0.246589 Co\n0.859372 0.899580 0.243245 Co\n0.119093 0.111102 0.489349 O\n0.128640 0.119858 0.994510 O\n0.118865 0.624284 0.484088 O\n0.131057 0.632482 0.992297 O\n0.617031 0.113848 0.490501 O\n0.629755 0.132847 0.998187 O\n0.615259 0.612050 0.487341 O\n0.631495 0.629560 0.991087 O\n0.132634 0.388441 0.017070 O\n0.135909 0.368644 0.503864 O\n0.137197 0.883322 0.018816 O\n0.140007 0.878708 0.504718 O\n0.640735 0.387915 0.017839 O\n0.631825 0.370498 0.504346 O\n0.631545 0.888259 0.016919 O\n0.634968 0.864268 0.501417 O\n0.362935 0.123016 0.487400 O\n0.378429 0.110144 0.994701 O\n0.370762 0.624352 0.484674 O\n0.381486 0.621821 0.992093 O\n0.869114 0.120665 0.490850 O\n0.877716 0.119747 0.998200 O\n0.869497 0.625887 0.488397 O\n0.882302 0.611940 0.990629 O\n0.388034 0.385103 0.018244 O\n0.385013 0.387069 0.503618 O\n0.381804 0.877004 0.016474 O\n0.384041 0.885660 0.504022 O\n0.883094 0.382006 0.016966 O\n0.880410 0.377229 0.505430 O\n0.885071 0.877286 0.015585 O\n0.890235 0.882386 0.503053 O\n0.095369 0.105015 0.145582 O\n0.096298 0.092490 0.645798 O\n0.086863 0.603819 0.137619 O\n0.080025 0.594375 0.642218 O\n0.586876 0.107619 0.140108 O\n0.578892 0.089442 0.639026 O\n0.589872 0.606951 0.143136 O\n0.581517 0.591027 0.642251 O\n0.432415 0.400086 0.347708 O\n0.449401 0.402549 0.860937 O\n0.440545 0.898048 0.357186 O\n0.448750 0.902267 0.864674 O\n0.932045 0.404945 0.353426 O\n0.948185 0.402633 0.865843 O\n0.941542 0.898792 0.352527 O\n0.951781 0.897749 0.860615 O\n0.332045 0.290802 0.136683 O\n0.333744 0.292682 0.641275 O\n0.339787 0.780265 0.141372 O\n0.332777 0.795903 0.644975 O\n0.846454 0.290083 0.145245 O\n0.832105 0.300351 0.648207 O\n0.842937 0.783324 0.139037 O\n0.831312 0.795501 0.639091 O\n0.184485 0.200649 0.354739 O\n0.195069 0.206033 0.868384 O\n0.192446 0.706103 0.348860 O\n0.204497 0.714728 0.861390 O\n0.681776 0.192490 0.350572 O\n0.683655 0.210616 0.853985 O\n0.697162 0.696925 0.355813 O\n0.707675 0.711544 0.862892 O\n0.422234 0.055922 0.238648 O\n0.422447 0.065087 0.745687 O\n0.427306 0.568916 0.247579 O\n0.431308 0.574804 0.758770 O\n0.924153 0.057063 0.239234 O\n0.935180 0.064741 0.751882 O\n0.926711 0.570037 0.247309 O\n0.932986 0.574501 0.761883 O\n0.172780 0.434391 0.237760 O\n0.182408 0.438113 0.753033 O\n0.173625 0.927376 0.248051 O\n0.182556 0.933907 0.761607 O\n0.673087 0.430574 0.238743 O\n0.678371 0.436521 0.761136 O\n0.677764 0.928526 0.237619 O\n0.685663 0.942521 0.752906 O\n",
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"energy": -1009.71337088,
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{
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"structure_string": "K20 Co2 Mo14 O54\n1.0\n8.033231 0.000000 0.000000\n0.000000 10.756435 0.000000\n0.000000 0.000000 18.629146\nK Co Mo O\n20 2 14 54\ndirect\n0.878815 0.097056 0.000000 K\n0.121185 0.597056 0.500000 K\n0.233990 0.861257 0.153551 K\n0.766010 0.361257 0.346449 K\n0.766010 0.361257 0.653551 K\n0.233990 0.861257 0.846449 K\n0.556107 0.174695 0.179458 K\n0.443893 0.674695 0.320542 K\n0.443893 0.674695 0.679458 K\n0.556107 0.174695 0.820542 K\n0.597372 0.746398 0.000000 K\n0.402628 0.246398 0.500000 K\n0.119396 0.003527 0.358407 K\n0.880604 0.503527 0.141593 K\n0.880604 0.503527 0.858407 K\n0.119396 0.003527 0.641593 K\n0.241142 0.346173 0.316540 K\n0.758858 0.846173 0.183460 K\n0.758858 0.846173 0.816540 K\n0.241142 0.346173 0.683460 K\n0.217278 0.355037 0.000000 Co\n0.782722 0.855037 0.500000 Co\n0.059357 0.682070 0.000000 Mo\n0.940643 0.182070 0.500000 Mo\n0.406775 0.519457 0.153558 Mo\n0.593225 0.019457 0.346442 Mo\n0.593225 0.019457 0.653558 Mo\n0.406775 0.519457 0.846442 Mo\n0.610103 0.366562 0.000000 Mo\n0.389897 0.866562 0.500000 Mo\n0.037754 0.190751 0.165505 Mo\n0.962246 0.690751 0.334495 Mo\n0.962246 0.690751 0.665505 Mo\n0.037754 0.190751 0.834495 Mo\n0.399623 0.045082 0.000000 Mo\n0.600377 0.545082 0.500000 Mo\n0.049975 0.236481 0.421230 O\n0.950025 0.736481 0.078770 O\n0.950025 0.736481 0.921230 O\n0.049975 0.236481 0.578770 O\n0.096419 0.561480 0.354109 O\n0.903581 0.061480 0.145891 O\n0.903581 0.061480 0.854109 O\n0.096419 0.561480 0.645891 O\n0.396832 0.428319 0.068799 O\n0.603168 0.928319 0.431201 O\n0.603168 0.928319 0.568799 O\n0.396832 0.428319 0.931201 O\n0.497378 0.482453 0.422165 O\n0.502622 0.982453 0.077835 O\n0.502622 0.982453 0.922165 O\n0.497378 0.482453 0.577835 O\n0.266988 0.740305 0.000000 O\n0.733012 0.240305 0.500000 O\n0.220228 0.133038 0.210145 O\n0.779772 0.633038 0.289855 O\n0.779772 0.633038 0.710145 O\n0.220228 0.133038 0.789855 O\n0.094385 0.268841 0.082462 O\n0.905615 0.768841 0.417538 O\n0.905615 0.768841 0.582462 O\n0.094385 0.268841 0.917538 O\n0.496810 0.425870 0.223300 O\n0.503190 0.925870 0.276700 O\n0.503190 0.925870 0.723300 O\n0.496810 0.425870 0.776700 O\n0.473037 0.159153 0.354612 O\n0.526963 0.659153 0.145388 O\n0.526963 0.659153 0.854612 O\n0.473037 0.159153 0.645388 O\n0.414551 0.216141 0.000000 O\n0.585449 0.716141 0.500000 O\n0.061812 0.798796 0.274733 O\n0.938188 0.298796 0.225267 O\n0.938188 0.298796 0.774733 O\n0.061812 0.798796 0.725267 O\n0.204873 0.560695 0.181389 O\n0.795127 0.060695 0.318611 O\n0.795127 0.060695 0.681389 O\n0.204873 0.560695 0.818611 O\n0.188128 0.002524 0.000000 O\n0.811872 0.502524 0.500000 O\n0.068484 0.513832 0.000000 O\n0.931516 0.013832 0.500000 O\n0.706310 0.294512 0.075236 O\n0.293690 0.794512 0.424764 O\n0.293690 0.794512 0.575236 O\n0.706310 0.294512 0.924764 O\n0.696908 0.517933 0.000000 O\n0.303092 0.017933 0.500000 O\n",
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{
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