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{
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"results": [
{
"id": "jvasp-26765",
"created_at": "2022-09-04T14:38:27.607563Z",
"updated_at": "2022-09-04T14:38:27.607586Z",
"structure_string": "Dy4 Te10 O26\n1.0\n6.972750 -0.018635 0.018045\n-2.243286 -8.339104 -0.012549\n-0.514085 0.023978 -10.545461\nDy Te O\n4 10 26\ndirect\n0.554211 0.470737 0.820370 Dy\n0.997863 0.264951 0.762158 Dy\n0.002137 0.735048 0.237842 Dy\n0.445789 0.529263 0.179631 Dy\n0.874876 0.345467 0.107127 Te\n0.156584 0.196741 0.366966 Te\n0.125124 0.654533 0.892873 Te\n0.567000 0.908652 0.304990 Te\n0.843416 0.803258 0.633035 Te\n0.709365 0.882698 0.970704 Te\n0.726276 0.393276 0.479273 Te\n0.290635 0.117302 0.029296 Te\n0.273724 0.606724 0.520727 Te\n0.433000 0.091348 0.695011 Te\n0.344020 0.009389 0.875120 O\n0.533612 0.674403 0.997076 O\n0.538221 0.189746 0.512960 O\n0.044600 0.650953 0.437671 O\n0.933695 0.267644 0.281954 O\n0.940287 0.018030 0.685604 O\n0.955400 0.349046 0.562330 O\n0.671497 0.743237 0.770188 O\n0.941041 0.820319 0.033889 O\n0.338331 0.487916 0.385325 O\n0.238813 0.505720 0.813249 O\n0.059713 0.981970 0.314396 O\n0.328503 0.256763 0.229812 O\n0.466388 0.325596 0.002925 O\n0.687563 0.737111 0.289763 O\n0.058959 0.179680 0.966111 O\n0.667374 0.220140 0.776647 O\n0.761187 0.494280 0.186751 O\n0.312438 0.262888 0.710238 O\n0.661669 0.512084 0.614675 O\n0.461780 0.810254 0.487040 O\n0.879179 0.487792 0.891823 O\n0.120821 0.512208 0.108177 O\n0.655980 0.990611 0.124881 O\n0.066305 0.732356 0.718046 O\n0.332626 0.779860 0.223354 O\n",
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{
"id": "jvasp-22954",
"created_at": "2022-09-04T14:38:20.087384Z",
"updated_at": "2022-09-04T14:38:20.087404Z",
"structure_string": "Li12 Ga4 Ge4 O20\n1.0\n4.980660 0.000000 0.000000\n0.000000 5.480020 0.000000\n0.000000 0.000000 15.849888\nLi Ga Ge O\n12 4 4 20\ndirect\n0.492236 0.324509 0.403187 Li\n0.492120 0.329016 0.803034 Li\n0.992120 0.670984 0.196966 Li\n0.992120 0.170984 0.303034 Li\n0.494944 0.339427 0.995464 Li\n0.994944 0.660573 0.004536 Li\n0.492120 0.829016 0.696966 Li\n0.494944 0.839427 0.504536 Li\n0.492236 0.824509 0.096813 Li\n0.992236 0.175491 0.903187 Li\n0.992236 0.675491 0.596814 Li\n0.994944 0.160573 0.495464 Li\n0.492167 0.831747 0.299455 Ga\n0.492167 0.331747 0.200545 Ga\n0.992167 0.668253 0.799455 Ga\n0.992167 0.168253 0.700545 Ga\n0.498194 0.339893 0.595928 Ge\n0.998194 0.660107 0.404072 Ge\n0.998194 0.160107 0.095928 Ge\n0.498194 0.839893 0.904073 Ge\n0.597648 0.656242 0.204231 O\n0.097648 0.343757 0.795769 O\n0.113171 0.818857 0.308029 O\n0.613171 0.181143 0.691971 O\n0.613171 0.681143 0.808029 O\n0.113171 0.318857 0.191971 O\n0.102757 0.355528 0.397971 O\n0.602757 0.644472 0.602029 O\n0.602757 0.144472 0.897972 O\n0.102757 0.855527 0.102029 O\n0.604198 0.177927 0.507037 O\n0.604198 0.677927 0.992963 O\n0.104198 0.322073 0.007037 O\n0.632563 0.177464 0.104420 O\n0.132563 0.322536 0.604420 O\n0.132563 0.822536 0.895580 O\n0.597648 0.156242 0.295769 O\n0.632563 0.677464 0.395580 O\n0.104198 0.822073 0.492963 O\n0.097648 0.843757 0.704232 O\n",
"nsites": 40,
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"elements": [
"Li",
"Ga",
"Ge",
"O"
],
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"density": 3.7337657133567537,
"density_atomic": 0.09246231314880814,
"volume": 432.6086882081817,
"volume_molar": 6.513076035971557,
"formula_full": "Li12 Ga4 Ge4 O20",
"formula_reduced": "Li3GaGeO5",
"formula_anonymous": "ABC3D5",
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"spacegroup": 33
},
{
"id": "jvasp-24263",
"created_at": "2022-09-04T14:38:06.440542Z",
"updated_at": "2022-09-04T14:38:06.440572Z",
"structure_string": "Cd8 Se8 O24\n1.0\n0.000000 5.813967 -0.010624\n12.918994 0.000000 0.000000\n0.000000 -1.675696 -8.460574\nCd Se O\n8 8 24\ndirect\n0.618002 0.758000 0.139430 Cd\n0.177841 0.576290 0.883020 Cd\n0.381998 0.258000 0.360570 Cd\n0.822159 0.076290 0.616979 Cd\n0.381997 0.242000 0.860569 Cd\n0.177841 0.923710 0.383020 Cd\n0.618002 0.742000 0.639429 Cd\n0.822159 0.423710 0.116979 Cd\n0.023320 0.666606 0.466722 Se\n0.582158 0.029206 0.230547 Se\n0.976680 0.166607 0.033277 Se\n0.582157 0.470793 0.730547 Se\n0.417842 0.529206 0.269452 Se\n0.976679 0.333393 0.533277 Se\n0.417842 0.970793 0.769452 Se\n0.023320 0.833393 0.966722 Se\n0.240541 0.761124 0.495460 O\n0.959058 0.641626 0.650522 O\n0.040941 0.141626 0.849477 O\n0.759459 0.261124 0.004540 O\n0.225469 0.241433 0.093709 O\n0.399706 0.419649 0.848915 O\n0.457004 0.907216 0.218727 O\n0.542996 0.092784 0.781272 O\n0.457004 0.592784 0.718726 O\n0.600293 0.919649 0.651084 O\n0.240541 0.738875 -0.004540 O\n0.959058 0.858373 0.150523 O\n0.774531 0.758567 0.906290 O\n0.840079 0.478099 0.866733 O\n0.600294 0.580350 0.151084 O\n0.840079 0.021901 0.366733 O\n0.542996 0.407216 0.281273 O\n0.159921 0.521901 0.133267 O\n0.225468 0.258567 0.593709 O\n0.159921 0.978099 0.633266 O\n0.759459 0.238876 0.504539 O\n0.040942 0.358374 0.349477 O\n0.774531 0.741433 0.406290 O\n0.399706 0.080350 0.348916 O\n",
"nsites": 40,
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"elements": [
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],
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"density": 5.002062509466479,
"density_atomic": 0.06292188914182752,
"volume": 635.7088216127618,
"volume_molar": 9.570820015314453,
"formula_full": "Cd8 Se8 O24",
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},
{
"id": "jvasp-25548",
"created_at": "2022-09-04T14:38:09.976337Z",
"updated_at": "2022-09-04T14:38:09.976360Z",
"structure_string": "Rb6 As2 Se32\n1.0\n10.254503 0.000000 5.920440\n3.418168 9.668038 5.920440\n0.000000 0.000000 11.840880\nRb As Se\n6 2 32\ndirect\n-0.000000 -0.000000 0.500000 Rb\n0.000000 0.500000 -0.000000 Rb\n0.000000 0.000000 0.000000 Rb\n0.625000 0.625000 0.625000 Rb\n0.375000 0.375000 0.375000 Rb\n0.500000 -0.000000 0.000000 Rb\n0.125000 0.125000 0.125000 As\n0.875000 0.875000 0.875000 As\n0.468331 0.053611 0.303582 Se\n0.053611 0.468331 0.674476 Se\n0.674476 0.468331 0.303582 Se\n0.674476 0.053611 0.468331 Se\n0.468331 0.303582 0.674476 Se\n0.303582 0.468331 0.053611 Se\n0.468331 0.674476 0.053611 Se\n0.303582 0.053611 0.674476 Se\n0.053611 0.674476 0.303582 Se\n0.674476 0.303582 0.053611 Se\n0.696418 0.325524 0.531669 Se\n0.531669 0.946389 0.696418 Se\n0.946389 0.531669 0.325524 Se\n0.325524 0.531669 0.696418 Se\n0.303582 0.674476 0.468331 Se\n0.325524 0.946389 0.531669 Se\n0.531669 0.696418 0.325524 Se\n0.696418 0.531669 0.946389 Se\n0.053611 0.303582 0.468331 Se\n0.696418 0.946389 0.325524 Se\n0.946389 0.325524 0.696418 Se\n0.325524 0.696418 0.946389 Se\n0.793281 0.793281 0.793281 Se\n0.120157 0.793281 0.793281 Se\n0.793281 0.793281 0.120156 Se\n0.793281 0.120156 0.793281 Se\n0.206719 0.206719 0.206719 Se\n0.879844 0.206719 0.206719 Se\n0.206719 0.206719 0.879845 Se\n0.206719 0.879845 0.206719 Se\n0.946389 0.696418 0.531669 Se\n0.531669 0.325524 0.946389 Se\n",
"nsites": 40,
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"elements": [
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],
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"density": 4.511459440430067,
"density_atomic": 0.03407399429064625,
"volume": 1173.9157921670637,
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{
"id": "jvasp-24288",
"created_at": "2022-09-04T14:38:20.530643Z",
"updated_at": "2022-09-04T14:38:20.530656Z",
"structure_string": "Er4 Te10 O26\n1.0\n6.912572 -0.019428 0.010383\n2.247174 8.314130 0.009521\n0.539385 0.014602 10.508749\nEr Te O\n4 10 26\ndirect\n0.553561 0.531001 0.180379 Er\n0.998915 0.736121 0.238310 Er\n0.446439 0.468999 0.819621 Er\n0.001085 0.263878 0.761689 Er\n0.127407 0.346487 0.105778 Te\n0.290786 0.882182 0.970498 Te\n0.434726 0.909370 0.304609 Te\n0.727281 0.605472 0.521075 Te\n0.841901 0.196784 0.366525 Te\n0.565274 0.090630 0.695391 Te\n0.709214 0.117817 0.029502 Te\n0.272719 0.394527 0.478925 Te\n0.158099 0.803216 0.633475 Te\n0.872593 0.653513 0.894222 Te\n0.761758 0.502779 0.813526 O\n0.468561 0.673505 -0.001532 O\n0.538552 0.810626 0.487473 O\n0.942699 0.179633 0.964031 O\n0.345875 0.991664 0.123841 O\n0.936181 0.981595 0.312368 O\n0.063819 0.018405 0.687632 O\n0.687846 0.262008 0.710697 O\n0.531438 0.326495 0.001532 O\n0.670081 0.777867 0.223206 O\n0.238242 0.497220 0.186474 O\n0.668216 0.259997 0.229122 O\n0.312155 0.737992 0.289302 O\n0.932490 0.732879 0.718057 O\n0.339731 0.511763 0.615118 O\n0.329919 0.222133 0.776794 O\n0.067511 0.267121 0.281943 O\n0.461448 0.189373 0.512527 O\n0.331784 0.740003 0.770878 O\n0.876747 0.511688 0.106837 O\n0.057301 0.820367 0.035969 O\n0.654125 0.008335 0.876159 O\n0.042039 0.350166 0.563759 O\n0.660270 0.488237 0.384882 O\n0.123253 0.488312 0.893163 O\n0.957962 0.649833 0.436240 O\n",
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],
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"density": 6.4870244112473685,
"density_atomic": 0.06618456008527174,
"volume": 604.3705654077669,
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"formula_full": "Er4 Te10 O26",
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{
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"created_at": "2022-09-04T14:37:38.083322Z",
"updated_at": "2022-09-04T14:37:38.083355Z",
"structure_string": "Sr8 In4 F28\n1.0\n0.000000 5.490570 0.002264\n12.380367 0.000000 0.000000\n0.000000 -0.089167 -8.358019\nSr In F\n8 4 28\ndirect\n0.763681 0.278498 0.554656 Sr\n0.236318 0.778498 0.945344 Sr\n0.236319 0.721503 0.445344 Sr\n0.763681 0.221503 0.054656 Sr\n0.236634 0.062342 0.324982 Sr\n0.763366 0.562343 0.175019 Sr\n0.763366 0.937658 0.675019 Sr\n0.236634 0.437658 0.824982 Sr\n0.279970 0.124546 0.788230 In\n0.720029 0.624546 0.711771 In\n0.279971 0.375454 0.288230 In\n0.720029 0.875454 0.211771 In\n0.988293 0.755265 0.692757 F\n0.495827 0.103945 0.573993 F\n0.011706 0.244735 0.307243 F\n0.988294 0.744735 0.192757 F\n0.011706 0.255265 0.807243 F\n0.201721 0.543181 0.286617 F\n0.986920 0.895920 0.411032 F\n0.986920 0.604080 0.911032 F\n0.013079 0.104080 0.588968 F\n0.798279 0.043181 0.213383 F\n0.504172 0.603945 0.926008 F\n0.013079 0.395920 0.088968 F\n0.504172 0.896056 0.426008 F\n0.364097 0.927546 0.124674 F\n0.495907 0.271289 0.798853 F\n0.504092 0.771289 0.701148 F\n0.504092 0.728712 0.201148 F\n0.495907 0.228712 0.298853 F\n0.201721 0.956819 0.786617 F\n0.635903 0.427546 0.375326 F\n0.635903 0.072455 0.875326 F\n0.364096 0.572455 0.624674 F\n0.791202 0.641803 0.463354 F\n0.208798 0.141802 0.036647 F\n0.208797 0.358198 0.536647 F\n0.791202 0.858198 0.963354 F\n0.495828 0.396055 0.073993 F\n0.798279 0.456819 0.713383 F\n",
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],
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{
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"created_at": "2022-09-04T14:37:37.947679Z",
"updated_at": "2022-09-04T14:37:37.947699Z",
"structure_string": "Sc16 O24\n1.0\n8.067874 -0.000000 -2.852425\n-4.033937 6.986984 -2.852425\n0.000000 0.000000 8.557273\nSc O\n16 24\ndirect\n0.249999 0.714217 0.464218 Sc\n0.499999 0.500000 0.500000 Sc\n-0.000000 -0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n-0.000000 0.500000 0.000000 Sc\n0.250000 0.214217 0.964217 Sc\n0.535782 0.750000 0.285783 Sc\n0.285782 0.535782 0.750000 Sc\n0.964217 0.250000 0.214218 Sc\n0.749999 0.285782 0.535783 Sc\n0.749999 0.785782 0.035783 Sc\n0.714217 0.464217 0.250000 Sc\n0.464217 0.250000 0.714218 Sc\n0.785782 0.035782 0.750000 Sc\n0.214217 0.964217 0.250000 Sc\n0.035782 0.750000 0.785782 Sc\n0.227215 0.453588 0.464462 O\n0.035538 0.489125 0.762753 O\n0.226372 0.272784 0.737247 O\n0.273627 0.010874 0.046412 O\n0.535537 0.772784 0.546412 O\n0.272784 0.737247 0.226373 O\n0.989125 0.953588 0.726373 O\n0.262752 0.773627 0.727216 O\n0.510874 0.237247 0.964462 O\n0.953587 0.726372 0.989126 O\n0.727215 0.262753 0.773627 O\n0.237246 0.964461 0.510874 O\n0.546411 0.535538 0.772784 O\n0.762753 0.035538 0.489126 O\n0.772784 0.546411 0.535538 O\n0.773626 0.727215 0.262753 O\n0.964461 0.510874 0.237247 O\n0.464461 0.227216 0.453588 O\n0.010874 0.046412 0.273627 O\n0.737247 0.226373 0.272785 O\n0.489125 0.762753 0.035539 O\n0.046411 0.273627 0.010874 O\n0.726372 0.989125 0.953588 O\n0.453588 0.464461 0.227216 O\n",
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},
{
"id": "jvasp-29301",
"created_at": "2022-09-04T14:38:00.632785Z",
"updated_at": "2022-09-04T14:38:00.632801Z",
"structure_string": "Mo4 As8 O28\n1.0\n4.580831 0.000000 0.000000\n0.000000 7.623657 -1.274126\n0.000000 -0.082572 16.421834\nMo As O\n4 8 28\ndirect\n0.000757 0.164795 0.098239 Mo\n0.499242 0.664795 0.598239 Mo\n0.500757 0.335206 0.401761 Mo\n0.999241 0.835207 0.901761 Mo\n0.959537 0.677829 0.441668 As\n0.952125 0.108225 0.714674 As\n0.047874 0.891775 0.285325 As\n0.452124 0.391775 0.785325 As\n0.040464 0.322172 0.558331 As\n0.540464 0.177828 0.941668 As\n0.459536 0.822173 0.058333 As\n0.547873 0.608225 0.214675 As\n0.741443 0.427881 0.524268 O\n0.241443 0.072119 0.975732 O\n0.258557 0.572119 0.475733 O\n0.758557 0.927881 0.024267 O\n0.270641 0.838820 0.623232 O\n0.770642 0.661181 0.876767 O\n0.729357 0.161180 0.376768 O\n0.229359 0.338820 0.123232 O\n0.327635 0.174280 0.732285 O\n0.096043 0.840822 0.393837 O\n0.827635 0.325720 0.767714 O\n0.672364 0.825720 0.267714 O\n0.172366 0.674280 0.232285 O\n0.718655 0.669720 0.681874 O\n0.218655 0.830281 0.818125 O\n0.281345 0.330280 0.318125 O\n0.781344 0.169720 0.181875 O\n0.403957 0.340822 0.893838 O\n0.249960 0.221737 0.476718 O\n0.750038 0.778264 0.523281 O\n0.250040 0.721737 0.976718 O\n0.249237 0.966981 0.126152 O\n0.749237 0.533020 0.373847 O\n0.750761 0.033020 0.873847 O\n0.250763 0.466981 0.626152 O\n0.596043 0.659179 0.106163 O\n0.749961 0.278264 0.023281 O\n0.903958 0.159179 0.606162 O\n",
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{
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{
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{
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