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{
"id": "mp-851075",
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"structure_string": "Li16 V20 O48\n1.0\n9.193605 0.000000 0.000000\n0.000000 9.011711 0.000000\n0.000000 8.807002 12.829238\nLi V O\n16 20 48\ndirect\n0.912567 0.130851 0.797545 Li\n0.595211 0.755831 0.226003 Li\n0.325404 0.347057 0.530233 Li\n0.230531 0.506809 0.309352 Li\n0.730531 0.493191 0.190648 Li\n0.825404 0.652943 0.969767 Li\n0.095211 0.244169 0.273997 Li\n0.412567 0.869149 0.702455 Li\n0.587433 0.130851 0.297545 Li\n0.904789 0.755831 0.726003 Li\n0.174596 0.347057 0.030233 Li\n0.269469 0.506809 0.809352 Li\n0.769469 0.493191 0.690648 Li\n0.674596 0.652943 0.469767 Li\n0.404789 0.244169 0.773997 Li\n0.087433 0.869149 0.202455 Li\n0.033042 0.636104 0.118725 V\n0.533042 0.363896 0.381275 V\n0.466958 0.636104 0.618725 V\n0.966958 0.363896 0.881275 V\n0.749398 0.954192 0.006052 V\n0.618214 0.234199 0.650096 V\n0.884777 0.536197 0.357999 V\n0.472115 0.857944 0.892606 V\n0.972115 0.142056 0.607394 V\n0.384777 0.463803 0.142001 V\n0.118214 0.765801 0.849904 V\n0.249398 0.045808 0.493948 V\n0.750602 0.954192 0.506052 V\n0.881786 0.234199 0.150096 V\n0.615223 0.536197 0.857999 V\n0.027885 0.857944 0.392606 V\n0.527885 0.142056 0.107394 V\n0.115223 0.463803 0.642001 V\n0.381786 0.765801 0.349904 V\n0.250602 0.045808 0.993948 V\n0.424786 0.615254 0.315588 O\n0.135175 0.318669 0.602104 O\n0.325481 0.032415 0.894816 O\n0.120966 0.883341 0.068258 O\n0.625619 0.982604 0.913880 O\n0.809028 0.217246 0.662273 O\n0.563449 0.336783 0.522799 O\n0.717223 0.531310 0.304876 O\n0.018829 0.614945 0.261952 O\n0.818567 0.732343 0.065068 O\n0.505133 0.044898 0.730599 O\n0.932831 0.321656 0.460369 O\n0.005133 0.955102 0.769401 O\n0.432831 0.678344 0.039631 O\n0.318567 0.267657 0.434932 O\n0.063449 0.663217 0.977201 O\n0.518829 0.385055 0.238048 O\n0.217223 0.468690 0.195124 O\n0.309028 0.782754 0.837727 O\n0.125619 0.017396 0.586120 O\n0.825481 0.967585 0.605184 O\n0.635175 0.681331 0.897896 O\n0.620966 0.116659 0.431742 O\n0.924786 0.384746 0.184412 O\n0.075214 0.615254 0.815588 O\n0.379034 0.883341 0.568258 O\n0.364825 0.318669 0.102104 O\n0.174519 0.032415 0.394816 O\n0.874381 0.982604 0.413880 O\n0.690972 0.217246 0.162273 O\n0.782777 0.531310 0.804876 O\n0.481171 0.614945 0.761952 O\n0.936551 0.336783 0.022799 O\n0.681433 0.732343 0.565068 O\n0.567169 0.321656 0.960369 O\n0.994867 0.044898 0.230599 O\n0.067169 0.678344 0.539631 O\n0.494867 0.955102 0.269401 O\n0.181433 0.267657 0.934932 O\n0.981171 0.385055 0.738048 O\n0.282777 0.468690 0.695124 O\n0.436551 0.663217 0.477201 O\n0.190972 0.782754 0.337727 O\n0.374381 0.017396 0.086120 O\n0.879034 0.116659 0.931742 O\n0.674519 0.967585 0.105184 O\n0.864825 0.681331 0.397896 O\n0.575214 0.384746 0.684412 O\n",
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"formula_full": "Li16 V20 O48",
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},
{
"id": "mp-1212005",
"created_at": "2022-09-04T14:40:16.032919Z",
"structure_string": "K12 Li12 W12 O48\n1.0\n9.230302 0.000000 0.000000\n0.000000 9.667967 0.000000\n0.000000 9.608075 16.854406\nK Li W O\n12 12 12 48\ndirect\n0.470561 0.847450 0.912520 K\n0.529439 0.152550 0.087480 K\n0.970561 0.152550 0.587480 K\n0.029439 0.847450 0.412520 K\n0.008079 0.501121 0.751936 K\n0.991921 0.498879 0.248064 K\n0.508079 0.498879 0.748064 K\n0.491921 0.501121 0.251936 K\n0.036639 0.804502 0.929890 K\n0.963361 0.195498 0.070110 K\n0.536639 0.195498 0.570110 K\n0.463361 0.804502 0.429890 K\n0.669560 0.840612 0.590864 Li\n0.330440 0.159388 0.409136 Li\n0.169560 0.159388 0.909136 Li\n0.830440 0.840612 0.090864 Li\n0.170161 0.519222 0.579985 Li\n0.829839 0.480778 0.420015 Li\n0.670161 0.480778 0.920015 Li\n0.329839 0.519222 0.079985 Li\n0.168006 0.822424 0.760642 Li\n0.831994 0.177576 0.239358 Li\n0.668006 0.177576 0.739358 Li\n0.331994 0.822424 0.260642 Li\n0.287177 0.475824 0.918277 W\n0.712823 0.524176 0.081723 W\n0.787177 0.524176 0.581723 W\n0.212823 0.475824 0.418277 W\n0.285127 0.841022 0.592572 W\n0.714873 0.158978 0.407428 W\n0.785127 0.158978 0.907428 W\n0.214873 0.841022 0.092572 W\n0.782941 0.813456 0.763336 W\n0.217059 0.186544 0.236664 W\n0.282941 0.186544 0.736664 W\n0.717059 0.813456 0.263336 W\n0.267154 0.614661 0.812959 O\n0.732846 0.385339 0.187041 O\n0.767154 0.385339 0.687041 O\n0.232846 0.614661 0.312959 O\n0.254254 0.579076 0.973981 O\n0.745746 0.420924 0.026019 O\n0.754254 0.420924 0.526019 O\n0.245746 0.579076 0.473981 O\n0.157664 0.896708 0.646269 O\n0.842336 0.103292 0.353731 O\n0.657664 0.103292 0.853731 O\n0.342336 0.896708 0.146269 O\n0.252214 0.950857 0.986470 O\n0.747786 0.049143 0.013530 O\n0.752214 0.049143 0.513530 O\n0.247786 0.950857 0.486470 O\n0.161242 0.310743 0.949675 O\n0.838758 0.689257 0.050325 O\n0.661242 0.689257 0.550325 O\n0.338758 0.310743 0.449675 O\n0.249565 0.973124 0.789640 O\n0.750435 0.026876 0.210360 O\n0.749565 0.026876 0.710360 O\n0.250435 0.973124 0.289640 O\n0.765445 0.737070 0.694895 O\n0.234555 0.262930 0.305105 O\n0.265445 0.262930 0.805105 O\n0.734555 0.737070 0.194895 O\n0.158100 0.288107 0.653934 O\n0.841900 0.711893 0.346066 O\n0.658100 0.711893 0.846066 O\n0.341900 0.288107 0.153934 O\n0.468422 0.883399 0.610151 O\n0.531578 0.116601 0.389849 O\n0.968422 0.116601 0.889849 O\n0.031578 0.883399 0.110151 O\n0.967308 0.774443 0.801294 O\n0.032692 0.225557 0.198706 O\n0.467308 0.225557 0.698706 O\n0.532692 0.774443 0.301294 O\n0.275020 0.628964 0.626653 O\n0.724980 0.371036 0.373347 O\n0.775020 0.371036 0.873347 O\n0.224980 0.628964 0.126653 O\n0.970935 0.600478 0.563941 O\n0.029065 0.399522 0.436059 O\n0.470935 0.399522 0.936059 O\n0.529065 0.600478 0.063941 O\n",
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"elements": [
"K",
"Li",
"W",
"O"
],
"chemical_system": "K-Li-O-W",
"density": 3.893420150239324,
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"formula_full": "K12 Li12 W12 O48",
"formula_reduced": "KLiWO4",
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},
{
"id": "mp-757819",
"created_at": "2022-09-04T14:40:19.430223Z",
"structure_string": "Li12 Ni12 P12 O48\n1.0\n7.418997 0.000000 0.000000\n0.000000 8.537772 0.000000\n0.000000 8.111377 15.169438\nLi Ni P O\n12 12 12 48\ndirect\n0.978796 0.295531 0.932861 Li\n0.028185 0.642126 0.585625 Li\n0.063303 0.001299 0.243141 Li\n0.563303 0.998701 0.256859 Li\n0.528185 0.357874 0.914375 Li\n0.478796 0.704469 0.567139 Li\n0.521204 0.295531 0.432861 Li\n0.471815 0.642126 0.085625 Li\n0.436697 0.001299 0.743141 Li\n0.936697 0.998701 0.756859 Li\n0.971815 0.357874 0.414375 Li\n0.021204 0.704469 0.067139 Li\n0.688944 0.646813 0.405249 Ni\n0.814126 0.327703 0.762063 Ni\n0.680221 0.001770 0.079100 Ni\n0.180221 0.998230 0.420900 Ni\n0.314126 0.672297 0.737937 Ni\n0.188944 0.353187 0.094751 Ni\n0.811056 0.646813 0.905249 Ni\n0.685874 0.327703 0.262063 Ni\n0.819779 0.001770 0.579100 Ni\n0.319779 0.998230 0.920900 Ni\n0.185874 0.672297 0.237937 Ni\n0.311056 0.353187 0.594751 Ni\n0.264905 0.657169 0.405907 P\n0.227085 0.308322 0.767097 P\n0.260389 0.029716 0.077812 P\n0.760389 0.970284 0.422188 P\n0.727085 0.691678 0.732903 P\n0.764905 0.342831 0.094093 P\n0.235095 0.657169 0.905907 P\n0.272915 0.308322 0.267097 P\n0.239611 0.029716 0.577812 P\n0.739611 0.970284 0.922188 P\n0.772915 0.691678 0.232903 P\n0.735095 0.342831 0.594093 P\n0.442715 0.579584 0.389905 O\n0.886620 0.401927 0.637866 O\n0.383938 0.255198 0.834925 O\n0.226957 0.584111 0.505914 O\n0.787220 0.099671 0.959944 O\n0.760709 0.804994 0.282008 O\n0.260991 0.922982 0.180268 O\n0.050832 0.267432 0.822182 O\n0.446323 0.118733 0.040702 O\n0.232002 0.507156 0.694564 O\n0.125417 0.187268 0.045920 O\n0.269876 0.863346 0.361314 O\n0.769876 0.136654 0.138686 O\n0.625417 0.812732 0.454080 O\n0.732002 0.492844 0.805436 O\n0.946323 0.881267 0.459298 O\n0.550832 0.732568 0.677818 O\n0.760991 0.077018 0.319732 O\n0.260709 0.195006 0.217992 O\n0.287220 0.900329 0.540056 O\n0.726957 0.415889 0.994086 O\n0.883938 0.744802 0.665075 O\n0.386620 0.598073 0.862134 O\n0.942715 0.420416 0.110095 O\n0.057285 0.579584 0.889905 O\n0.613380 0.401927 0.137866 O\n0.116062 0.255198 0.334925 O\n0.273043 0.584111 0.005914 O\n0.712780 0.099671 0.459944 O\n0.739291 0.804994 0.782008 O\n0.239009 0.922982 0.680268 O\n0.449168 0.267432 0.322182 O\n0.053677 0.118733 0.540702 O\n0.267998 0.507156 0.194564 O\n0.374583 0.187268 0.545920 O\n0.230124 0.863346 0.861314 O\n0.730124 0.136654 0.638686 O\n0.767998 0.492844 0.305436 O\n0.874583 0.812732 0.954080 O\n0.553677 0.881267 0.959298 O\n0.949168 0.732568 0.177818 O\n0.739009 0.077018 0.819732 O\n0.239291 0.195006 0.717992 O\n0.212780 0.900329 0.040056 O\n0.773043 0.415889 0.494086 O\n0.616062 0.744802 0.165075 O\n0.113380 0.598073 0.362134 O\n0.557285 0.420416 0.610095 O\n",
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"elements": [
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"formula_full": "Li12 Ni12 P12 O48",
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},
{
"id": "mp-1223492",
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"structure_string": "Na12 Pb8 S12 Cl4 O48\n1.0\n0.000000 0.000000 -7.143301\n5.021368 -8.667134 0.000000\n-15.065691 -8.665371 0.000000\nNa Pb S Cl O\n12 8 12 4 48\ndirect\n0.747292 0.732757 0.004581 Na\n0.247292 0.267243 0.995419 Na\n0.752340 0.639442 0.630482 Na\n0.252340 0.360558 0.369518 Na\n0.505886 0.506689 0.838769 Na\n0.005886 0.493311 0.161231 Na\n0.492804 0.498806 0.164612 Na\n0.992804 0.501194 0.835388 Na\n0.493959 0.996651 0.667190 Na\n0.993959 0.003349 0.332810 Na\n0.505848 0.002982 0.334922 Na\n0.005848 0.997018 0.665078 Na\n0.754368 0.129576 0.119347 Pb\n0.254368 0.870424 0.880653 Pb\n0.749142 0.617116 0.373659 Pb\n0.249142 0.382884 0.626341 Pb\n0.748448 0.249131 0.499379 Pb\n0.248448 0.750869 0.500621 Pb\n0.748888 0.124602 0.874559 Pb\n0.248888 0.875398 0.125441 Pb\n0.749646 0.278539 0.689490 S\n0.249646 0.721461 0.310510 S\n0.751342 0.830002 0.793778 S\n0.251342 0.169998 0.206222 S\n0.752045 0.326149 0.296203 S\n0.252045 0.673851 0.703797 S\n0.749118 0.775306 0.193719 S\n0.249118 0.224694 0.806281 S\n0.751311 0.897417 0.518700 S\n0.251311 0.102583 0.481300 S\n0.746084 0.393823 0.018058 S\n0.246084 0.606177 0.981942 S\n0.521792 0.985578 0.000140 Cl\n0.021792 0.014422 0.999860 Cl\n0.481409 0.493525 0.493559 Cl\n0.981409 0.506475 0.506441 Cl\n0.909527 0.787841 0.139107 O\n0.409527 0.212159 0.860893 O\n0.073416 0.225884 0.852524 O\n0.573416 0.774116 0.147476 O\n0.918081 0.401830 0.326388 O\n0.418081 0.598170 0.673612 O\n0.080883 0.597401 0.680197 O\n0.580883 0.402599 0.319803 O\n0.924161 0.827720 0.545346 O\n0.424161 0.172280 0.454654 O\n0.086931 0.184818 0.457527 O\n0.586931 0.815182 0.542473 O\n0.920571 0.273852 0.639176 O\n0.420571 0.726148 0.360824 O\n0.085841 0.716033 0.365027 O\n0.585841 0.283967 0.634973 O\n0.748092 0.414442 0.933434 O\n0.248092 0.585558 0.066566 O\n0.764411 0.640916 0.232768 O\n0.264411 0.359084 0.767232 O\n0.756764 0.826882 0.708751 O\n0.256764 0.173118 0.291249 O\n0.749337 0.695456 0.828089 O\n0.249337 0.304544 0.171911 O\n0.917296 0.910064 0.822616 O\n0.417296 0.089936 0.177384 O\n0.081570 0.089822 0.181728 O\n0.581570 0.910178 0.818272 O\n0.739122 0.148674 0.732117 O\n0.239122 0.851326 0.267883 O\n0.749151 0.188433 0.327273 O\n0.249151 0.811567 0.672727 O\n0.749415 0.884097 0.251630 O\n0.249415 0.115903 0.748370 O\n0.760995 0.324470 0.209742 O\n0.260995 0.675530 0.790258 O\n0.751479 0.393570 0.742405 O\n0.251479 0.606430 0.257595 O\n0.917382 0.317341 0.043381 O\n0.417382 0.682659 0.956619 O\n0.080079 0.690536 0.959079 O\n0.580079 0.309464 0.040921 O\n0.741043 0.028838 0.561738 O\n0.241043 0.971162 0.438262 O\n0.739573 0.522294 0.060679 O\n0.239573 0.477706 0.939321 O\n0.753163 0.919852 0.434450 O\n0.253163 0.080148 0.565550 O\n",
"nsites": 84,
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"elements": [
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"formula_full": "Na12 Pb8 S12 Cl4 O48",
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},
{
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{
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