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{
"id": "mp-557024",
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"structure_string": "Si48 O96\n1.0\n14.434509 0.000000 0.000000\n0.000000 14.434509 0.000000\n0.000000 0.000000 14.434509\nSi O\n48 96\ndirect\n0.104593 0.727594 0.808468 Si\n0.727594 0.191532 0.895407 Si\n0.191532 0.104593 0.272406 Si\n0.104593 0.272406 0.808468 Si\n0.104593 0.272406 0.191532 Si\n0.772406 0.604593 0.308468 Si\n0.272406 0.191532 0.104593 Si\n0.308468 0.227594 0.604593 Si\n0.604593 0.308468 0.227594 Si\n0.395407 0.691532 0.772406 Si\n0.308468 0.772406 0.395407 Si\n0.308468 0.227594 0.395407 Si\n0.808468 0.895407 0.272406 Si\n0.808468 0.104593 0.727594 Si\n0.191532 0.895407 0.272406 Si\n0.727594 0.808468 0.104593 Si\n0.727594 0.191532 0.104593 Si\n0.772406 0.395407 0.308468 Si\n0.604593 0.691532 0.227594 Si\n0.395407 0.308468 0.772406 Si\n0.308468 0.772406 0.604593 Si\n0.895407 0.272406 0.191532 Si\n0.272406 0.808468 0.104593 Si\n0.191532 0.895407 0.727594 Si\n0.191532 0.104593 0.727594 Si\n0.691532 0.227594 0.604593 Si\n0.395407 0.308468 0.227594 Si\n0.227594 0.604593 0.308468 Si\n0.227594 0.604593 0.691532 Si\n0.727594 0.808468 0.895407 Si\n0.604593 0.691532 0.772406 Si\n0.104593 0.727594 0.191532 Si\n0.772406 0.604593 0.691532 Si\n0.691532 0.772406 0.395407 Si\n0.808468 0.895407 0.727594 Si\n0.808468 0.104593 0.272406 Si\n0.895407 0.727594 0.808468 Si\n0.691532 0.227594 0.395407 Si\n0.395407 0.691532 0.227594 Si\n0.772406 0.395407 0.691532 Si\n0.227594 0.395407 0.308468 Si\n0.895407 0.272406 0.808468 Si\n0.227594 0.395407 0.691532 Si\n0.272406 0.191532 0.895407 Si\n0.272406 0.808468 0.895407 Si\n0.604593 0.308468 0.772406 Si\n0.691532 0.772406 0.604593 Si\n0.895407 0.727594 0.191532 Si\n0.107209 0.821022 0.743106 O\n0.821022 0.743106 0.892791 O\n0.847279 0.000000 0.287486 O\n0.321022 0.392791 0.756894 O\n0.712514 0.152721 0.000000 O\n0.607209 0.243106 0.678978 O\n0.000000 0.712514 0.847279 O\n0.500000 0.652721 0.787486 O\n0.743106 0.107209 0.821022 O\n0.107209 0.178978 0.743106 O\n0.135722 0.635722 0.750000 O\n0.635722 0.750000 0.864278 O\n0.500000 0.347279 0.212514 O\n0.892791 0.178978 0.743106 O\n0.250000 0.135722 0.364278 O\n0.743106 0.892791 0.821022 O\n0.212514 0.500000 0.652721 O\n0.256894 0.107209 0.178978 O\n0.135722 0.635722 0.250000 O\n0.243106 0.678978 0.607209 O\n0.743106 0.892791 0.178978 O\n0.107209 0.821022 0.256894 O\n0.250000 0.864278 0.635722 O\n0.787486 0.500000 0.347279 O\n0.347279 0.787486 0.500000 O\n0.756894 0.678978 0.392791 O\n0.364278 0.750000 0.864278 O\n0.750000 0.864278 0.364278 O\n0.712514 0.847279 0.000000 O\n0.178978 0.743106 0.107209 O\n0.678978 0.392791 0.756894 O\n0.500000 0.347279 0.787486 O\n0.347279 0.212514 0.500000 O\n0.000000 0.287486 0.847279 O\n0.392791 0.243106 0.678978 O\n0.750000 0.135722 0.364278 O\n0.750000 0.135722 0.635722 O\n0.750000 0.864278 0.635722 O\n0.652721 0.212514 0.500000 O\n0.821022 0.256894 0.107209 O\n0.250000 0.135722 0.635722 O\n0.892791 0.821022 0.256894 O\n0.135722 0.364278 0.750000 O\n0.607209 0.756894 0.678978 O\n0.256894 0.107209 0.821022 O\n0.364278 0.250000 0.135722 O\n0.135722 0.364278 0.250000 O\n0.178978 0.256894 0.107209 O\n0.743106 0.107209 0.178978 O\n0.243106 0.678978 0.392791 O\n0.178978 0.256894 0.892791 O\n0.500000 0.652721 0.212514 O\n0.256894 0.892791 0.178978 O\n0.787486 0.500000 0.652721 O\n0.364278 0.250000 0.864278 O\n0.000000 0.287486 0.152721 O\n0.864278 0.364278 0.750000 O\n0.256894 0.892791 0.821022 O\n0.321022 0.392791 0.243106 O\n0.678978 0.392791 0.243106 O\n0.635722 0.750000 0.135722 O\n0.635722 0.250000 0.864278 O\n0.152721 0.000000 0.287486 O\n0.635722 0.250000 0.135722 O\n0.392791 0.756894 0.321022 O\n0.152721 0.000000 0.712514 O\n0.892791 0.821022 0.743106 O\n0.892791 0.178978 0.256894 O\n0.243106 0.321022 0.392791 O\n0.287486 0.152721 0.000000 O\n0.287486 0.847279 0.000000 O\n0.392791 0.756894 0.678978 O\n0.243106 0.321022 0.607209 O\n0.107209 0.178978 0.256894 O\n0.178978 0.743106 0.892791 O\n0.607209 0.243106 0.321022 O\n0.364278 0.750000 0.135722 O\n0.864278 0.364278 0.250000 O\n0.212514 0.500000 0.347279 O\n0.392791 0.243106 0.321022 O\n0.864278 0.635722 0.250000 O\n0.678978 0.607209 0.243106 O\n0.821022 0.256894 0.892791 O\n0.321022 0.607209 0.243106 O\n0.652721 0.787486 0.500000 O\n0.000000 0.712514 0.152721 O\n0.250000 0.864278 0.364278 O\n0.756894 0.678978 0.607209 O\n0.756894 0.321022 0.392791 O\n0.321022 0.607209 0.756894 O\n0.678978 0.607209 0.756894 O\n0.607209 0.756894 0.321022 O\n0.821022 0.743106 0.107209 O\n0.864278 0.635722 0.750000 O\n0.756894 0.321022 0.607209 O\n0.847279 0.000000 0.712514 O\n",
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"elements": [
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"density": 1.5923747917106772,
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"volume": 3007.502845446469,
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"formula_full": "Si48 O96",
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"updated_at": "2021-11-28T01:34:39.487000Z",
"spacegroup": 223
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{
"id": "mp-600068",
"created_at": "2022-09-04T14:40:19.075351Z",
"structure_string": "Si10 O20\n1.0\n5.180941 -6.032676 0.000000\n5.180941 6.032676 0.000000\n0.000000 0.000000 10.142856\nSi O\n10 20\ndirect\n0.821100 0.390779 0.849081 Si\n0.609221 0.178900 0.650919 Si\n0.390779 0.821100 0.650919 Si\n0.178900 0.609221 0.849081 Si\n0.178900 0.609221 0.150919 Si\n0.390779 0.821100 0.349081 Si\n0.609221 0.178900 0.349081 Si\n0.821100 0.390779 0.150919 Si\n0.500000 0.500000 0.750000 Si\n0.500000 0.500000 0.250000 Si\n0.670426 0.510211 0.841446 O\n0.489789 0.329574 0.658554 O\n0.510211 0.670426 0.658554 O\n0.329574 0.489789 0.841446 O\n0.329574 0.489789 0.158554 O\n0.510211 0.670426 0.341446 O\n0.489789 0.329574 0.341446 O\n0.670426 0.510211 0.158554 O\n0.838808 0.324624 0.000000 O\n0.675376 0.161192 0.500000 O\n0.324624 0.838808 0.500000 O\n0.161192 0.675376 0.000000 O\n0.771520 0.228480 0.750000 O\n0.228480 0.771520 0.750000 O\n0.228480 0.771520 0.250000 O\n0.771520 0.228480 0.250000 O\n0.000000 0.500000 0.801445 O\n0.500000 0.000000 0.698555 O\n0.000000 0.500000 0.198555 O\n0.500000 0.000000 0.301445 O\n",
"nsites": 30,
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"elements": [
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"density": 1.5736248321321527,
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"volume": 634.028679530494,
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"formula_full": "Si10 O20",
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"energy": -250.22341974,
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"updated_at": "2021-11-28T01:34:55.222000Z",
"spacegroup": 66
},
{
"id": "mp-600057",
"created_at": "2022-09-04T14:40:04.677731Z",
"structure_string": "Si24 O48\n1.0\n-5.162771 6.333532 10.943940\n5.162771 -6.333532 10.943940\n5.162771 6.333532 -10.943940\nSi O\n24 48\ndirect\n0.482605 0.332789 0.592894 Si\n0.517395 0.110289 0.850184 Si\n0.760104 0.667211 0.649816 Si\n0.239896 0.889711 0.907106 Si\n0.517395 0.667211 0.407106 Si\n0.482605 0.889711 0.149816 Si\n0.239896 0.332789 0.350184 Si\n0.760104 0.110289 0.092894 Si\n0.215489 0.656879 0.558611 Si\n0.784511 0.343121 0.441389 Si\n0.401732 0.343121 0.058611 Si\n0.598268 0.656879 0.941389 Si\n0.668191 0.792995 0.875196 Si\n0.331809 0.207005 0.124804 Si\n0.582201 0.207005 0.375196 Si\n0.417799 0.792995 0.624804 Si\n0.307845 0.433065 0.874780 Si\n0.692155 0.566935 0.125220 Si\n0.941715 0.566935 0.374780 Si\n0.058285 0.433065 0.625220 Si\n0.000000 0.718362 0.718362 Si\n0.500000 0.281638 0.781638 Si\n0.000000 0.281638 0.281638 Si\n0.500000 0.718362 0.218362 Si\n0.503508 0.245471 0.641488 O\n0.496492 0.137980 0.741963 O\n0.896016 0.754529 0.758037 O\n0.103984 0.862020 0.858512 O\n0.496492 0.754529 0.358512 O\n0.503508 0.862020 0.258037 O\n0.103984 0.245471 0.241963 O\n0.896016 0.137980 0.141488 O\n0.511281 0.504381 0.752278 O\n0.488719 0.240997 0.993100 O\n0.747897 0.495619 0.506900 O\n0.252103 0.759003 0.747722 O\n0.488719 0.495619 0.247722 O\n0.511281 0.759003 0.006900 O\n0.252103 0.504381 0.493100 O\n0.747897 0.240997 0.252278 O\n0.573239 0.297656 0.534415 O\n0.426761 0.961176 0.724417 O\n0.736759 0.702344 0.775583 O\n0.263241 0.038824 0.965585 O\n0.426761 0.702344 0.465585 O\n0.573239 0.038824 0.275583 O\n0.263241 0.297656 0.224417 O\n0.736759 0.961176 0.034415 O\n0.341143 0.281819 0.440677 O\n0.658857 0.099534 0.940677 O\n0.658857 0.718181 0.559323 O\n0.341143 0.900466 0.059323 O\n0.069354 0.632035 0.437319 O\n0.930646 0.367965 0.562681 O\n0.305284 0.367965 0.937319 O\n0.694716 0.632035 0.062681 O\n0.286211 0.730875 0.555335 O\n0.713789 0.269125 0.444665 O\n0.324460 0.269125 0.055335 O\n0.675540 0.730875 0.944665 O\n0.525274 0.775274 0.750000 O\n0.474726 0.224726 0.250000 O\n0.377620 0.601153 0.033504 O\n0.622380 0.655884 0.223533 O\n0.932351 0.398847 0.276467 O\n0.067649 0.344116 0.466496 O\n0.622380 0.398847 0.966496 O\n0.377620 0.344116 0.776467 O\n0.067649 0.601153 0.723533 O\n0.932351 0.655884 0.533504 O\n0.168689 0.418689 0.750000 O\n0.831311 0.581311 0.250000 O\n",
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"density": 1.6728570051511673,
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"formula_full": "Si24 O48",
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"spacegroup": 74
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{
"id": "mp-1244945",
"created_at": "2022-09-04T14:40:08.091800Z",
"structure_string": "Si30 O60\n1.0\n11.235420 0.040406 -0.076083\n0.040493 11.119922 -0.040675\n-0.071973 -0.039428 11.507193\nSi O\n30 60\ndirect\n0.160677 0.515201 0.202243 Si\n0.700569 0.090758 0.814380 Si\n0.145068 0.605226 0.953173 Si\n0.973411 0.753292 0.090089 Si\n0.135994 0.792064 0.283003 Si\n0.909453 0.913484 0.712506 Si\n0.277909 0.771124 0.632096 Si\n0.175901 0.388428 0.542483 Si\n0.081215 0.886263 0.523523 Si\n0.094311 0.055249 0.834043 Si\n0.352172 0.492906 0.366066 Si\n0.337648 0.106375 0.927607 Si\n0.523387 0.057791 0.015991 Si\n0.745421 0.730778 0.603125 Si\n0.781149 0.505489 0.441642 Si\n0.289659 0.319200 0.764555 Si\n0.896654 0.256937 0.890079 Si\n0.366232 0.584315 0.816374 Si\n0.621383 0.694345 0.829249 Si\n0.624373 0.910019 0.422500 Si\n0.568643 0.310568 0.422212 Si\n0.057338 0.428182 0.773230 Si\n0.262448 0.021382 0.635013 Si\n0.523699 0.110457 0.598462 Si\n0.842497 0.284114 0.160633 Si\n0.797882 0.569320 0.191445 Si\n0.387614 0.771217 0.379083 Si\n0.734702 0.724685 0.000154 Si\n0.648404 0.102241 0.243689 Si\n0.998611 0.355009 0.357041 Si\n0.283856 0.632125 0.923430 O\n0.681114 0.400688 0.438381 O\n0.746023 0.175340 0.167675 O\n0.357580 0.780994 0.516004 O\n0.930305 0.374552 0.812912 O\n0.188024 0.986545 0.515758 O\n0.251343 0.488447 0.469541 O\n0.699326 0.644529 0.113814 O\n0.850765 0.809406 0.031025 O\n0.134494 0.772260 0.600639 O\n0.076964 0.556408 0.837320 O\n0.056222 0.832256 0.394552 O\n0.744791 0.631061 0.885204 O\n0.646274 0.060130 0.941716 O\n0.198580 0.061851 0.936774 O\n0.158568 0.333872 0.822895 O\n0.770017 0.593324 0.328148 O\n0.796635 0.994187 0.759099 O\n0.908633 0.434749 0.437518 O\n0.991104 0.149611 0.866750 O\n0.424392 0.983224 0.932782 O\n0.926001 0.629620 0.154526 O\n0.423955 0.173027 0.028309 O\n0.380476 0.094550 0.604282 O\n0.503691 0.615225 0.842695 O\n0.513274 0.840143 0.357445 O\n0.056770 0.436758 0.258022 O\n0.623076 0.799245 0.936571 O\n0.562189 0.031006 0.150250 O\n0.964824 0.949367 0.584309 O\n0.928224 0.255560 0.275767 O\n0.021039 0.928280 0.807573 O\n0.049147 0.843007 0.177117 O\n0.276802 0.831818 0.301457 O\n0.572937 0.002228 0.518479 O\n0.271609 0.312884 0.622413 O\n0.454122 0.393517 0.391021 O\n0.364855 0.439324 0.797782 O\n0.351521 0.199417 0.817984 O\n0.770909 0.593790 0.555381 O\n0.289611 0.459279 0.240912 O\n0.101612 0.304760 0.447276 O\n0.069284 0.723708 0.989473 O\n0.632313 0.731694 0.693203 O\n0.899570 0.279163 0.030939 O\n0.407190 0.627551 0.353873 O\n0.858306 0.778186 0.683500 O\n0.316850 0.650738 0.699635 O\n0.791396 0.423342 0.171509 O\n0.696380 0.991882 0.327779 O\n0.163714 0.091519 0.714822 O\n0.767620 0.218463 0.837130 O\n0.551019 0.242159 0.544911 O\n0.583606 0.207071 0.321675 O\n0.713296 0.816651 0.491692 O\n0.302296 0.897128 0.704317 O\n0.589646 0.104500 0.724230 O\n0.146411 0.511325 0.061870 O\n0.148531 0.648458 0.260316 O\n0.078529 0.446443 0.633631 O\n",
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{
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{
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{
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}