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{
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"results": [
{
"id": "mp-773187",
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"structure_string": "Li4 Mn3 V5 O16\n1.0\n5.842538 0.000000 0.000000\n-2.746428 5.218303 0.000000\n-0.083156 -0.342856 9.551155\nLi Mn V O\n4 3 5 16\ndirect\n0.339196 0.683166 0.104048 Li\n0.999134 0.003702 0.006904 Li\n0.003632 0.993259 0.506459 Li\n0.669117 0.332599 0.601458 Li\n0.170576 0.337261 0.788398 Mn\n0.342214 0.173643 0.285900 Mn\n0.832469 0.167922 0.288237 Mn\n0.172333 0.827539 0.783395 V\n0.334319 0.654289 0.512557 V\n0.657766 0.832596 0.788401 V\n0.836729 0.659758 0.284411 V\n0.667529 0.348105 0.011881 V\n0.158399 0.796310 0.409111 O\n0.467168 0.961191 0.657806 O\n0.318969 0.668490 0.895737 O\n0.004337 0.998441 0.694488 O\n0.001319 0.996117 0.194891 O\n0.665654 0.798855 0.399706 O\n0.040320 0.518016 0.660355 O\n0.491912 0.535770 0.648336 O\n0.831968 0.672182 0.897359 O\n0.165426 0.315577 0.407532 O\n0.535195 0.499876 0.145392 O\n0.967569 0.506048 0.155609 O\n0.670637 0.336620 0.390601 O\n0.325365 0.169943 0.905088 O\n0.525771 0.052022 0.157656 O\n0.804677 0.160703 0.910443 O\n",
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},
{
"id": "mp-16984",
"created_at": "2022-09-04T14:39:16.428978Z",
"structure_string": "Sr6 Mg2 Rh2 O12\n1.0\n4.654132 -4.869372 0.000000\n4.654132 4.869372 0.000000\n-0.440435 0.000000 6.721439\nSr Mg Rh O\n6 2 2 12\ndirect\n0.615446 0.250000 0.884554 Sr\n0.884554 0.615446 0.250000 Sr\n0.750000 0.115446 0.384554 Sr\n0.384554 0.750000 0.115446 Sr\n0.115446 0.384554 0.750000 Sr\n0.250000 0.884554 0.615446 Sr\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.750000 Mg\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n0.593668 0.787487 0.462948 O\n0.462948 0.593668 0.787487 O\n0.787487 0.462948 0.593668 O\n0.906332 0.037052 0.712513 O\n0.712513 0.906332 0.037052 O\n0.037052 0.712513 0.906332 O\n0.406332 0.212513 0.537052 O\n0.537052 0.406332 0.212513 O\n0.212513 0.537052 0.406332 O\n0.093668 0.962948 0.287487 O\n0.962948 0.287487 0.093668 O\n0.287487 0.093668 0.962948 O\n",
"nsites": 22,
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"formula_full": "Sr6 Mg2 Rh2 O12",
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"updated_at": "2021-11-28T01:34:34.645000Z",
"spacegroup": 167
},
{
"id": "mp-556496",
"created_at": "2022-09-04T14:39:16.432370Z",
"structure_string": "Sr10 Al4 Si6 O1\n1.0\n-2.418414 6.679270 9.249146\n2.418414 -6.679270 9.249146\n2.418414 6.679270 -9.249146\nSr Al Si O\n10 4 6 1\ndirect\n0.843648 0.843648 0.000000 Sr\n0.187137 0.000000 0.187137 Sr\n0.469856 0.806835 0.663020 Sr\n0.856185 0.193165 0.663020 Sr\n0.812863 0.000000 0.812863 Sr\n0.000000 0.500000 0.500000 Sr\n0.156352 0.156352 0.000000 Sr\n0.530144 0.193165 0.336980 Sr\n0.500000 0.000000 0.500000 Sr\n0.143815 0.806835 0.336980 Sr\n0.413176 0.570624 0.842552 Al\n0.271928 0.429376 0.842552 Al\n0.586824 0.429376 0.157448 Al\n0.728072 0.570624 0.157448 Al\n0.690019 0.368218 0.321801 Si\n0.645617 0.645617 0.000000 Si\n0.309981 0.631782 0.678199 Si\n0.354383 0.354383 0.000000 Si\n0.046417 0.368218 0.678199 Si\n0.953583 0.631782 0.321801 Si\n0.000000 0.000000 0.000000 O\n",
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"formula_full": "Sr10 Al4 Si6 O1",
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"spacegroup": 71
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{
"id": "mp-1216469",
"created_at": "2022-09-04T14:39:16.433958Z",
"structure_string": "Yb18 B10 S42\n1.0\n11.309155 0.000000 0.000000\n-0.131118 11.350027 0.000000\n-0.410308 -0.374896 11.446558\nYb B S\n18 10 42\ndirect\n0.436870 0.278543 0.063261 Yb\n0.818556 0.575715 0.426066 Yb\n0.133429 0.927896 0.726519 Yb\n0.571841 0.419390 0.813389 Yb\n0.922851 0.736655 0.138633 Yb\n0.282589 0.063841 0.435187 Yb\n0.747727 0.134029 0.927678 Yb\n0.059169 0.434098 0.277420 Yb\n0.424827 0.825551 0.582221 Yb\n0.901764 0.100284 0.290263 Yb\n0.226845 0.428736 0.626025 Yb\n0.551131 0.786972 0.907408 Yb\n0.785024 0.909084 0.552133 Yb\n0.099903 0.287833 0.907706 Yb\n0.427152 0.622975 0.225136 Yb\n0.626237 0.238057 0.433215 Yb\n0.906527 0.547971 0.783492 Yb\n0.295827 0.902447 0.114179 Yb\n0.566894 0.913551 0.272269 B\n0.915411 0.265361 0.566499 B\n0.263006 0.571578 0.914445 B\n0.081699 0.742414 0.406793 B\n0.414278 0.079725 0.748124 B\n0.746778 0.410572 0.075531 B\n0.804945 0.803855 0.805017 B\n0.128072 0.122542 0.127590 B\n0.302344 0.304679 0.303826 B\n0.617111 0.621521 0.622864 B\n0.923199 0.801310 0.375570 S\n0.271089 0.150967 0.685430 S\n0.588044 0.476126 0.057671 S\n0.150240 0.697823 0.258404 S\n0.480700 0.065155 0.592644 S\n0.807560 0.375039 0.922915 S\n0.071443 0.587725 0.475635 S\n0.372020 0.926715 0.805130 S\n0.692906 0.265883 0.142920 S\n0.632900 0.792330 0.171138 S\n0.952175 0.093383 0.556034 S\n0.315212 0.420801 0.870807 S\n0.420119 0.866956 0.328047 S\n0.795650 0.164052 0.631098 S\n0.092385 0.574332 0.952311 S\n0.554870 0.947428 0.101008 S\n0.870712 0.321570 0.419914 S\n0.161554 0.642327 0.796304 S\n0.922638 0.777136 0.701645 S\n0.247336 0.121750 0.020919 S\n0.580292 0.465905 0.342322 S\n0.127208 0.013915 0.245569 S\n0.456669 0.351533 0.574035 S\n0.781232 0.700218 0.921755 S\n0.465750 0.494251 0.472157 S\n0.699936 0.922776 0.780274 S\n0.015140 0.238384 0.125698 S\n0.850013 0.965667 0.078960 S\n0.191397 0.289227 0.415308 S\n0.492138 0.634746 0.721143 S\n0.633608 0.725231 0.505594 S\n0.977768 0.070693 0.848080 S\n0.285712 0.418439 0.194181 S\n0.419411 0.195652 0.290177 S\n0.718796 0.497899 0.633975 S\n0.008345 0.976801 0.996876 S\n0.354761 0.680977 0.005481 S\n0.674986 0.010964 0.357032 S\n0.008753 0.349153 0.679602 S\n0.182108 0.847631 0.508260 S\n0.515952 0.178069 0.851131 S\n0.844669 0.513389 0.180155 S\n",
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"volume": 1469.2711947211246,
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"formula_full": "Yb18 B10 S42",
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"energy": -370.0970017,
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{
"id": "mp-1519497",
"created_at": "2022-09-04T14:39:16.435632Z",
"structure_string": "K4 Sr4 Nd4 Mn4 O24\n1.0\n8.426559 0.000000 0.000000\n0.000000 8.414896 0.000000\n0.000000 0.000000 8.433225\nK Sr Nd Mn O\n4 4 4 4 24\ndirect\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.250000 0.250000 0.250000 Nd\n0.750000 0.750000 0.250000 Nd\n0.750000 0.250000 0.750000 Nd\n0.250000 0.750000 0.750000 Nd\n0.750000 0.750000 0.750000 Mn\n0.250000 0.250000 0.750000 Mn\n0.250000 0.750000 0.250000 Mn\n0.750000 0.250000 0.250000 Mn\n0.975139 0.240389 0.259072 O\n0.024861 0.759611 0.259072 O\n0.024861 0.240389 0.740928 O\n0.975139 0.759611 0.740928 O\n0.260713 0.977113 0.224353 O\n0.260713 0.022887 0.775647 O\n0.739287 0.022887 0.224353 O\n0.739287 0.977113 0.775647 O\n0.238590 0.246910 0.976336 O\n0.761410 0.246910 0.023664 O\n0.238590 0.753090 0.023664 O\n0.761410 0.753090 0.976336 O\n0.524861 0.259611 0.240928 O\n0.475139 0.740389 0.240928 O\n0.475139 0.259611 0.759072 O\n0.524861 0.740389 0.759072 O\n0.239287 0.522887 0.275647 O\n0.239287 0.477113 0.724353 O\n0.760713 0.477113 0.275647 O\n0.760713 0.522887 0.724353 O\n0.261410 0.253090 0.523664 O\n0.738590 0.253090 0.476336 O\n0.261410 0.746910 0.476336 O\n0.738590 0.746910 0.523664 O\n",
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"formula_full": "K4 Sr4 Nd4 Mn4 O24",
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{
"id": "mp-1079802",
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"structure_string": "Y2 Ni2 Ge4\n1.0\n2.047265 -8.313818 0.000000\n2.047265 8.313818 0.000000\n0.000000 0.000000 4.207474\nY Ni Ge\n2 2 4\ndirect\n0.892442 0.107558 0.250000 Y\n0.107558 0.892442 0.750000 Y\n0.679441 0.320559 0.250000 Ni\n0.320559 0.679441 0.750000 Ni\n0.541557 0.458443 0.250000 Ge\n0.458443 0.541557 0.750000 Ge\n0.252514 0.747486 0.250000 Ge\n0.747486 0.252514 0.750000 Ge\n",
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{
"id": "mp-1112900",
"created_at": "2022-09-04T14:39:16.549153Z",
"structure_string": "Cs2 Tl1 Hg1 Br6\n1.0\n0.000000 5.769247 5.769247\n5.769247 0.000000 5.769247\n5.769247 5.769247 0.000000\nCs Tl Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Hg\n0.745695 0.254305 0.254305 Br\n0.254305 0.254305 0.745695 Br\n0.254305 0.745695 0.745695 Br\n0.254305 0.745695 0.254305 Br\n0.745695 0.254305 0.745695 Br\n0.745695 0.745695 0.254305 Br\n",
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{
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{
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}