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{
"id": "mp-28640",
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"updated_at": "2021-11-28T01:37:04.601000Z",
"spacegroup": 60
},
{
"id": "mp-556213",
"created_at": "2022-09-04T14:47:26.738613Z",
"structure_string": "K16 Mn16 V16 O64\n1.0\n5.720375 0.000000 0.000000\n0.000000 12.291397 0.000000\n0.000000 5.717637 23.611771\nK Mn V O\n16 16 16 64\ndirect\n0.786355 0.441206 0.187166 K\n0.284189 0.807011 0.064381 K\n0.270049 0.376671 0.304816 K\n0.215811 0.307011 0.564381 K\n0.770049 0.123329 0.195184 K\n0.272687 0.734556 0.315012 K\n0.213645 0.558794 0.812834 K\n0.227313 0.234556 0.815012 K\n0.784189 0.692989 0.435619 K\n0.772687 0.765444 0.184988 K\n0.715811 0.192989 0.935619 K\n0.729951 0.623329 0.695184 K\n0.286355 0.058794 0.312834 K\n0.727313 0.265444 0.684988 K\n0.229951 0.876671 0.804816 K\n0.713645 0.941206 0.687166 K\n0.235580 0.440577 0.681587 Mn\n0.742231 0.386055 0.439290 Mn\n0.764420 0.559423 0.318413 Mn\n0.257682 0.676366 0.941582 Mn\n0.242318 0.176366 0.441582 Mn\n0.742318 0.323634 0.058418 Mn\n0.277165 0.499627 0.077170 Mn\n0.757769 0.886055 0.939290 Mn\n0.222835 0.999627 0.577170 Mn\n0.777165 0.000373 0.422830 Mn\n0.242231 0.113945 0.060710 Mn\n0.735580 0.059423 0.818413 Mn\n0.257769 0.613945 0.560710 Mn\n0.722835 0.500373 0.922830 Mn\n0.757682 0.823634 0.558418 Mn\n0.264420 0.940577 0.181587 Mn\n0.270259 0.864655 0.463953 V\n0.726896 0.385760 0.791123 V\n0.754899 0.233928 0.347364 V\n0.770259 0.635345 0.036047 V\n0.229741 0.364655 0.963953 V\n0.245101 0.766072 0.652636 V\n0.773104 0.885760 0.291123 V\n0.226980 0.994316 0.929853 V\n0.254899 0.266072 0.152636 V\n0.226896 0.114240 0.708877 V\n0.273104 0.614240 0.208877 V\n0.726980 0.505684 0.570147 V\n0.273020 0.494316 0.429853 V\n0.745101 0.733928 0.847364 V\n0.773020 0.005684 0.070147 V\n0.729741 0.135345 0.536047 V\n0.494186 0.014480 0.892730 O\n0.252680 0.312649 0.906188 O\n0.749676 0.454931 0.509942 O\n0.747320 0.687351 0.093812 O\n0.221592 0.260361 0.688383 O\n0.815580 0.726127 0.781010 O\n0.750324 0.954931 0.009942 O\n0.954292 0.804031 0.635499 O\n0.386883 0.275412 0.019867 O\n0.283801 0.625745 0.648358 O\n0.924538 0.380424 0.978385 O\n0.505814 0.985520 0.107270 O\n0.979757 0.068520 0.749953 O\n0.150519 0.850192 0.946094 O\n0.249676 0.045069 0.990058 O\n0.278408 0.760361 0.188383 O\n0.501619 0.440737 0.613868 O\n0.734297 0.444241 0.849683 O\n0.454292 0.695969 0.864501 O\n0.783801 0.874255 0.851642 O\n0.563322 0.142622 0.395891 O\n0.184420 0.273873 0.218990 O\n0.247320 0.812649 0.406188 O\n0.045708 0.195969 0.364501 O\n0.315580 0.773873 0.718990 O\n0.545708 0.304031 0.135499 O\n0.936678 0.642622 0.895891 O\n0.265703 0.555759 0.150317 O\n0.627921 0.503425 0.050999 O\n0.436678 0.857378 0.604109 O\n0.778408 0.739639 0.311617 O\n0.849481 0.149808 0.053906 O\n0.886883 0.224588 0.480133 O\n0.998381 0.940737 0.113868 O\n0.127921 0.996575 0.449001 O\n0.765703 0.944241 0.349683 O\n0.020243 0.931480 0.250047 O\n0.530327 0.929460 0.247533 O\n0.613117 0.724588 0.980133 O\n0.424538 0.119576 0.521615 O\n0.001619 0.059263 0.886132 O\n0.969673 0.429460 0.747533 O\n0.250324 0.545069 0.490058 O\n0.234297 0.055759 0.650317 O\n0.372079 0.496575 0.949001 O\n0.872079 0.003425 0.550999 O\n0.063322 0.357378 0.104109 O\n0.075462 0.619576 0.021615 O\n0.216199 0.125745 0.148358 O\n0.520243 0.568520 0.249953 O\n0.349481 0.350192 0.446094 O\n0.575462 0.880424 0.478385 O\n0.113117 0.775412 0.519867 O\n0.650519 0.649808 0.553906 O\n0.005814 0.514480 0.392730 O\n0.498381 0.559263 0.386132 O\n0.469673 0.070540 0.752467 O\n0.752680 0.187351 0.593812 O\n0.994186 0.485520 0.607270 O\n0.721592 0.239639 0.811617 O\n0.716199 0.374255 0.351642 O\n0.684420 0.226127 0.281010 O\n0.479757 0.431480 0.750047 O\n0.030327 0.570540 0.252467 O\n",
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{
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{
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"elements": [
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"density": 4.216206413981069,
"density_atomic": 0.0852536044404464,
"volume": 1829.834656539047,
"volume_molar": 7.063796070002818,
"formula_full": "Sr4 Ca28 Ti8 Mn24 O92",
"formula_reduced": "SrCa7Ti2Mn6O23",
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"energy": -1232.43522155,
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"updated_at": "2021-11-28T01:36:10.845000Z",
"spacegroup": 1
},
{
"id": "mp-33325",
"created_at": "2022-09-04T14:41:14.410984Z",
"structure_string": "Mg8 Fe16 O32\n1.0\n3.020107 5.228423 0.000000\n-3.020107 5.228423 0.000000\n0.000000 3.522219 19.701581\nMg Fe O\n8 16 32\ndirect\n0.846350 0.846350 0.969504 Mg\n0.376156 0.376156 0.875080 Mg\n0.596691 0.596691 0.718399 Mg\n0.125630 0.125630 0.624596 Mg\n0.874979 0.874979 0.375175 Mg\n0.999865 0.999865 0.500350 Mg\n0.625330 0.625330 0.125663 Mg\n0.749778 0.749778 0.250478 Mg\n0.377812 0.866492 0.875244 Fe\n0.250269 0.250269 0.746998 Fe\n0.866492 0.377812 0.875244 Fe\n0.347783 0.347783 0.467209 Fe\n0.125539 0.621814 0.624971 Fe\n0.902477 0.902477 0.780781 Fe\n0.097522 0.097522 0.218411 Fe\n0.621814 0.125539 0.624971 Fe\n0.874846 0.374847 0.375300 Fe\n0.651997 0.651997 0.532791 Fe\n0.374847 0.874846 0.375300 Fe\n0.120023 0.627000 0.125603 Fe\n0.627000 0.120023 0.125603 Fe\n0.402246 0.402246 0.282529 Fe\n0.499979 0.499979 0.997217 Fe\n0.152642 0.152642 0.030449 Fe\n0.679964 0.215372 0.936173 O\n0.564151 0.564151 0.819745 O\n0.215372 0.679964 0.936173 O\n0.676667 0.676667 0.935381 O\n0.070454 0.070454 0.814417 O\n0.429524 0.967705 0.685611 O\n0.543145 0.068482 0.813953 O\n0.313793 0.313793 0.566049 O\n0.967705 0.429524 0.685611 O\n0.187100 0.187100 0.932685 O\n0.425730 0.425730 0.684886 O\n0.068482 0.543145 0.813953 O\n0.185132 0.704909 0.434907 O\n0.818788 0.818788 0.565739 O\n0.296684 0.814328 0.565237 O\n0.063258 0.063258 0.317625 O\n0.704909 0.185132 0.434907 O\n0.937129 0.937129 0.682909 O\n0.180236 0.180236 0.434384 O\n0.814328 0.296684 0.565237 O\n0.569566 0.569566 0.315199 O\n0.935704 0.452424 0.185255 O\n0.046160 0.564722 0.314662 O\n0.813538 0.813538 0.071462 O\n0.452424 0.935704 0.185255 O\n0.686708 0.686708 0.432295 O\n0.931446 0.931446 0.184789 O\n0.564722 0.046160 0.314662 O\n0.321185 0.321185 0.063974 O\n0.792543 0.318820 0.063492 O\n0.436564 0.436564 0.182017 O\n0.318820 0.792543 0.063492 O\n",
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{
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{
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{
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}