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{
"id": "mp-775486",
"created_at": "2022-09-04T14:46:52.205252Z",
"structure_string": "Li12 Sb8 P12 O48\n1.0\n9.204215 0.000000 0.000000\n0.000000 9.168161 0.000000\n0.000000 9.149704 13.027527\nLi Sb P O\n12 8 12 48\ndirect\n0.105393 0.215273 0.700945 Li\n0.722647 0.174833 0.743548 Li\n0.768259 0.610061 0.184102 Li\n0.268259 0.389939 0.315898 Li\n0.222647 0.825167 0.756452 Li\n0.605393 0.784727 0.799055 Li\n0.394607 0.215273 0.200945 Li\n0.777353 0.174833 0.243548 Li\n0.731741 0.610061 0.684102 Li\n0.231741 0.389939 0.815898 Li\n0.277353 0.825167 0.256452 Li\n0.894607 0.784727 0.299055 Li\n0.453670 0.662342 0.098621 Sb\n0.040575 0.844447 0.905196 Sb\n0.540575 0.155553 0.594804 Sb\n0.953670 0.337658 0.401379 Sb\n0.046330 0.662342 0.598621 Sb\n0.459425 0.844447 0.405196 Sb\n0.959425 0.155553 0.094804 Sb\n0.546330 0.337658 0.901379 Sb\n0.399424 0.063383 0.836541 P\n0.087929 0.740034 0.165229 P\n0.587929 0.259966 0.334771 P\n0.899424 0.936617 0.663459 P\n0.100576 0.063383 0.336541 P\n0.412071 0.740034 0.665229 P\n0.912071 0.259966 0.834771 P\n0.600576 0.936617 0.163459 P\n0.239575 0.455055 0.491263 P\n0.739575 0.544945 0.008737 P\n0.260425 0.455055 0.991263 P\n0.760425 0.544945 0.508737 P\n0.868566 0.560612 0.430021 O\n0.713545 0.351246 0.590598 O\n0.903041 0.095132 0.827942 O\n0.598389 0.760603 0.167551 O\n0.374012 0.337632 0.551309 O\n0.253594 0.055629 0.791892 O\n0.170315 0.378133 0.433672 O\n0.413913 0.902286 0.950715 O\n0.059457 0.800258 0.054493 O\n0.235077 0.643826 0.208495 O\n0.958129 0.623797 0.235130 O\n0.530019 0.062045 0.774662 O\n0.030019 0.937955 0.725338 O\n0.458129 0.376203 0.264870 O\n0.735077 0.356174 0.291505 O\n0.559457 0.199742 0.445507 O\n0.913913 0.097714 0.549285 O\n0.670315 0.621867 0.066328 O\n0.753594 0.944371 0.708108 O\n0.874012 0.662368 0.948691 O\n0.098389 0.239397 0.332449 O\n0.403041 0.904868 0.672058 O\n0.213545 0.648754 0.909402 O\n0.368566 0.439388 0.069979 O\n0.631434 0.560612 0.930021 O\n0.786455 0.351246 0.090598 O\n0.596959 0.095132 0.327942 O\n0.901611 0.760603 0.667551 O\n0.125988 0.337632 0.051309 O\n0.246406 0.055629 0.291892 O\n0.329685 0.378133 0.933672 O\n0.086087 0.902286 0.450715 O\n0.440543 0.800258 0.554493 O\n0.264923 0.643826 0.708495 O\n0.541871 0.623797 0.735130 O\n0.969981 0.062045 0.274662 O\n0.469981 0.937955 0.225338 O\n0.041871 0.376203 0.764870 O\n0.764923 0.356174 0.791505 O\n0.940543 0.199742 0.945507 O\n0.586087 0.097714 0.049285 O\n0.829685 0.621867 0.566328 O\n0.746406 0.944371 0.208108 O\n0.625988 0.662368 0.448691 O\n0.401611 0.239397 0.832449 O\n0.096959 0.904868 0.172058 O\n0.286455 0.648754 0.409402 O\n0.131434 0.439388 0.569979 O\n",
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"elements": [
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"P",
"O"
],
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"density_atomic": 0.0727711132985258,
"volume": 1099.3373108340318,
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"formula_full": "Li12 Sb8 P12 O48",
"formula_reduced": "Li3Sb2(PO4)3",
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"updated_at": "2021-11-28T01:37:40.380000Z",
"spacegroup": 14
},
{
"id": "mp-26605",
"created_at": "2022-09-04T14:46:52.116765Z",
"structure_string": "Li12 Cr8 P12 O48\n1.0\n6.627980 7.135092 0.000000\n-6.627980 7.135092 0.000000\n0.000000 0.931130 9.633336\nLi Cr P O\n12 8 12 48\ndirect\n0.238666 0.033104 0.395410 Li\n0.966896 0.761334 0.604590 Li\n0.731813 0.780783 0.175307 Li\n0.502404 0.977331 0.267688 Li\n0.752794 0.622080 0.828325 Li\n0.567685 0.768248 0.473709 Li\n0.911776 0.326141 0.977611 Li\n0.673859 0.088224 0.022389 Li\n0.231752 0.432315 0.526291 Li\n0.219217 0.268187 0.824693 Li\n0.022669 0.497596 0.732312 Li\n0.377920 0.247206 0.171675 Li\n0.252916 0.968411 0.782856 Cr\n0.963952 0.247928 0.279791 Cr\n0.466713 0.533287 0.000000 Cr\n0.249962 0.750038 0.000000 Cr\n0.749435 0.250565 0.500000 Cr\n0.531471 0.468529 0.500000 Cr\n0.752072 0.036048 0.720209 Cr\n0.031589 0.747084 0.217144 Cr\n0.448607 0.156305 0.574412 P\n0.650217 0.325081 0.199591 P\n0.342688 0.675337 0.302324 P\n0.324663 0.657312 0.697676 P\n0.674919 0.349783 0.800409 P\n0.843695 0.551393 0.425588 P\n0.551043 0.847117 0.930070 P\n0.822834 0.948510 0.405615 P\n0.169678 0.049685 0.099125 P\n0.051490 0.177166 0.594385 P\n0.152883 0.448957 0.069930 P\n0.950315 0.830322 0.900875 P\n0.091497 0.402644 0.940378 O\n0.617896 0.908383 0.793084 O\n0.696880 0.897449 0.343540 O\n0.909308 0.802035 0.058088 O\n0.914488 0.717083 0.810428 O\n0.819112 0.915244 0.566356 O\n0.962057 0.882394 0.348490 O\n0.881753 0.973583 0.857273 O\n0.026417 0.118247 0.142727 O\n0.117606 0.037943 0.651510 O\n0.084756 0.180888 0.433644 O\n0.282917 0.085512 0.189572 O\n0.197965 0.090692 0.941912 O\n0.102551 0.303120 0.656460 O\n0.091617 0.382104 0.206916 O\n0.410521 0.083620 0.450610 O\n0.377024 0.108889 0.716191 O\n0.916380 0.589479 0.549390 O\n0.312221 0.411181 0.064339 O\n0.122048 0.611386 0.076853 O\n0.575944 0.202161 0.158258 O\n0.411579 0.315912 0.561057 O\n0.612196 0.125870 0.585935 O\n0.205321 0.580870 0.654726 O\n0.184555 0.690196 0.334151 O\n0.390274 0.532639 0.372841 O\n0.826260 0.111348 0.371517 O\n0.622335 0.331659 0.363584 O\n0.693133 0.191932 0.841770 O\n0.376070 0.666796 0.137224 O\n0.161854 0.886553 0.125085 O\n0.594384 0.464680 0.135906 O\n0.535320 0.405616 0.864094 O\n0.113447 0.838146 0.874915 O\n0.333204 0.623930 0.862776 O\n0.808068 0.306867 0.158230 O\n0.668341 0.377665 0.636416 O\n0.888652 0.173740 0.628483 O\n0.467361 0.609726 0.627159 O\n0.309804 0.815445 0.665849 O\n0.891111 0.622976 0.283809 O\n0.874130 0.387804 0.414065 O\n0.684088 0.588421 0.438943 O\n0.797839 0.424056 0.841742 O\n0.388614 0.877952 0.923147 O\n0.588819 0.687779 0.935661 O\n0.597356 0.908503 0.059622 O\n0.419130 0.794679 0.345274 O\n",
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"elements": [
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"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P",
"density": 2.9868858483292438,
"density_atomic": 0.08780161747533367,
"volume": 911.1449458488005,
"volume_molar": 6.858803895830068,
"formula_full": "Li12 Cr8 P12 O48",
"formula_reduced": "Li3Cr2(PO4)3",
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"updated_at": "2021-11-28T01:37:43.868000Z",
"spacegroup": 5
},
{
"id": "mp-768553",
"created_at": "2022-09-04T14:46:51.370539Z",
"structure_string": "Li12 Cu8 S12 O48\n1.0\n8.778936 0.000000 0.000000\n0.000000 8.664666 0.000000\n0.000000 8.544097 12.643109\nLi Cu S O\n12 8 12 48\ndirect\n0.916997 0.378579 0.698424 Li\n0.303467 0.335117 0.753317 Li\n0.227117 0.030753 0.178906 Li\n0.727117 0.969247 0.321094 Li\n0.803467 0.664883 0.746683 Li\n0.416997 0.621421 0.801576 Li\n0.583003 0.378579 0.198424 Li\n0.196533 0.335117 0.253317 Li\n0.272883 0.030753 0.678906 Li\n0.772883 0.969247 0.821094 Li\n0.696533 0.664883 0.246683 Li\n0.083003 0.621421 0.301576 Li\n0.464283 0.648362 0.598258 Cu\n0.964283 0.351638 0.901742 Cu\n0.542206 0.144587 0.099509 Cu\n0.042206 0.855413 0.400491 Cu\n0.957794 0.144587 0.599509 Cu\n0.457794 0.855413 0.900491 Cu\n0.035717 0.648362 0.098258 Cu\n0.535717 0.351638 0.401742 Cu\n0.749649 0.545030 0.493875 S\n0.616278 0.250078 0.850557 S\n0.899895 0.943489 0.153473 S\n0.116278 0.749922 0.649443 S\n0.399895 0.056511 0.346527 S\n0.249649 0.454970 0.006125 S\n0.750351 0.545030 0.993875 S\n0.600105 0.943489 0.653473 S\n0.883722 0.250078 0.350557 S\n0.100105 0.056511 0.846527 S\n0.383722 0.749922 0.149443 S\n0.250351 0.454970 0.506125 S\n0.131915 0.597992 0.438352 O\n0.118117 0.230573 0.846161 O\n0.305378 0.478883 0.590942 O\n0.404301 0.895141 0.173075 O\n0.626717 0.523980 0.565097 O\n0.770156 0.339215 0.807868 O\n0.607393 0.166821 0.963892 O\n0.026273 0.903764 0.230598 O\n0.751432 0.962257 0.195930 O\n0.817666 0.735554 0.437838 O\n0.936128 0.106860 0.050293 O\n0.495006 0.396043 0.792743 O\n0.995006 0.603957 0.707257 O\n0.436128 0.893140 0.449707 O\n0.317666 0.264446 0.062162 O\n0.251432 0.037743 0.304070 O\n0.107393 0.833179 0.536108 O\n0.526273 0.096236 0.269402 O\n0.270156 0.660785 0.692132 O\n0.126717 0.476020 0.934903 O\n0.805378 0.521117 0.909058 O\n0.618117 0.769427 0.653839 O\n0.904301 0.104859 0.326925 O\n0.631915 0.402008 0.061648 O\n0.368085 0.597992 0.938352 O\n0.095699 0.895141 0.673075 O\n0.381883 0.230573 0.346161 O\n0.194622 0.478883 0.090942 O\n0.873283 0.523980 0.065097 O\n0.729844 0.339215 0.307868 O\n0.473727 0.903764 0.730598 O\n0.892607 0.166821 0.463892 O\n0.748568 0.962257 0.695930 O\n0.682334 0.735554 0.937838 O\n0.563872 0.106860 0.550293 O\n0.004994 0.396043 0.292743 O\n0.504994 0.603957 0.207257 O\n0.063872 0.893140 0.949707 O\n0.182334 0.264446 0.562162 O\n0.248568 0.037743 0.804070 O\n0.973727 0.096236 0.769402 O\n0.392607 0.833179 0.036108 O\n0.229844 0.660785 0.192132 O\n0.373283 0.476020 0.434903 O\n0.595699 0.104859 0.826925 O\n0.694622 0.521117 0.409058 O\n0.881883 0.769427 0.153839 O\n0.868085 0.402008 0.561648 O\n",
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"elements": [
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],
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"volume": 961.717661099341,
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"formula_full": "Li12 Cu8 S12 O48",
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},
{
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"structure_string": "Li12 Cr8 P12 O48\n1.0\n8.702882 0.000000 0.000000\n0.000000 8.428616 0.000000\n0.000000 0.471549 12.203384\nLi Cr P O\n12 8 12 48\ndirect\n0.809071 0.713460 0.948307 Li\n0.190929 0.286540 0.051693 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.895201 0.000000 0.250000 Li\n0.599019 0.500000 0.250000 Li\n0.104799 0.000000 0.750000 Li\n0.190929 0.713460 0.448307 Li\n0.500000 0.500000 0.500000 Li\n0.400981 0.500000 0.750000 Li\n0.809071 0.286540 0.551693 Li\n0.000000 0.000000 0.500000 Li\n0.999232 0.718549 0.141938 Cr\n0.999232 0.281451 0.358062 Cr\n0.497443 0.217632 0.143774 Cr\n0.497443 0.782368 0.356226 Cr\n0.502557 0.217632 0.643774 Cr\n0.502557 0.782368 0.856226 Cr\n0.000768 0.718549 0.641938 Cr\n0.000768 0.281451 0.858062 Cr\n0.360228 0.154066 0.893035 P\n0.797585 0.000000 0.750000 P\n0.853110 0.649977 0.397301 P\n0.146890 0.350023 0.602699 P\n0.639772 0.845934 0.106965 P\n0.639772 0.154066 0.393035 P\n0.853110 0.350023 0.102699 P\n0.287452 0.500000 0.250000 P\n0.712548 0.500000 0.750000 P\n0.146890 0.649977 0.897301 P\n0.360228 0.845934 0.606965 P\n0.202415 0.000000 0.250000 P\n0.411814 0.252582 0.992071 O\n0.190469 0.378083 0.313866 O\n0.675929 0.345703 0.087084 O\n0.190469 0.621917 0.186134 O\n0.397038 0.429451 0.161812 O\n0.091123 0.067903 0.337819 O\n0.581548 0.014833 0.108932 O\n0.295537 0.128514 0.187518 O\n0.704463 0.871486 0.812482 O\n0.418452 0.985167 0.891068 O\n0.908877 0.932097 0.662181 O\n0.602962 0.570549 0.838188 O\n0.809531 0.378083 0.813866 O\n0.324071 0.654297 0.912916 O\n0.809531 0.621917 0.686134 O\n0.057198 0.747411 0.983306 O\n0.908877 0.067903 0.837819 O\n0.942802 0.252589 0.016694 O\n0.942802 0.747411 0.483306 O\n0.408359 0.746997 0.710497 O\n0.108434 0.471496 0.906916 O\n0.095680 0.731211 0.787885 O\n0.602962 0.429451 0.661812 O\n0.581548 0.985167 0.391068 O\n0.408359 0.253003 0.789503 O\n0.180285 0.858469 0.593847 O\n0.704463 0.128514 0.687518 O\n0.904320 0.731211 0.287885 O\n0.891566 0.471496 0.406916 O\n0.411814 0.747418 0.507929 O\n0.675929 0.654297 0.412916 O\n0.180285 0.141531 0.906153 O\n0.819715 0.858469 0.093847 O\n0.324071 0.345703 0.587084 O\n0.588186 0.252582 0.492071 O\n0.108434 0.528504 0.593084 O\n0.095680 0.268789 0.712115 O\n0.295537 0.871486 0.312482 O\n0.819715 0.141531 0.406153 O\n0.591641 0.746997 0.210497 O\n0.091123 0.932097 0.162181 O\n0.397038 0.570549 0.338188 O\n0.904320 0.268789 0.212115 O\n0.891566 0.528504 0.093084 O\n0.591641 0.253003 0.289503 O\n0.057198 0.252589 0.516694 O\n0.588186 0.747418 0.007929 O\n0.418452 0.014833 0.608932 O\n",
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"formula_full": "Li12 Cr8 P12 O48",
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},
{
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