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{
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"results": [
{
"id": "mp-1040077",
"created_at": "2022-09-04T14:48:10.180359Z",
"structure_string": "Li1 Mg30 B1 O31\n1.0\n8.465058 0.000000 0.000000\n0.000000 8.465058 0.000000\n0.000000 0.000000 8.545604\nLi Mg B O\n1 30 1 31\ndirect\n0.000000 0.000000 0.991404 Li\n0.000000 0.500000 0.001170 Mg\n0.500000 0.000000 0.001170 Mg\n0.000000 0.000000 0.499986 Mg\n0.000000 0.500000 0.499148 Mg\n0.500000 0.000000 0.499148 Mg\n0.500000 0.500000 0.498512 Mg\n0.249655 0.249655 0.000057 Mg\n0.249655 0.750345 0.000057 Mg\n0.750345 0.249655 0.000057 Mg\n0.750345 0.750345 0.000057 Mg\n0.249294 0.249294 0.500487 Mg\n0.249294 0.750706 0.500487 Mg\n0.750706 0.249294 0.500487 Mg\n0.750706 0.750706 0.500487 Mg\n0.000000 0.249023 0.247180 Mg\n0.000000 0.750977 0.247180 Mg\n0.500000 0.258718 0.247785 Mg\n0.500000 0.741282 0.247785 Mg\n0.000000 0.246537 0.753223 Mg\n0.000000 0.753463 0.753223 Mg\n0.500000 0.244967 0.750838 Mg\n0.500000 0.755033 0.750838 Mg\n0.249023 0.000000 0.247180 Mg\n0.258718 0.500000 0.247785 Mg\n0.750977 0.000000 0.247180 Mg\n0.741282 0.500000 0.247785 Mg\n0.246537 0.000000 0.753223 Mg\n0.244967 0.500000 0.750838 Mg\n0.753463 0.000000 0.753223 Mg\n0.755033 0.500000 0.750838 Mg\n0.500000 0.500000 0.952153 B\n0.000000 0.500000 0.246245 O\n0.500000 0.000000 0.246245 O\n0.500000 0.500000 0.268422 O\n0.000000 0.000000 0.745276 O\n0.000000 0.500000 0.755379 O\n0.500000 0.000000 0.755379 O\n0.500000 0.500000 0.780532 O\n0.252048 0.252048 0.249053 O\n0.252048 0.747952 0.249053 O\n0.747952 0.252048 0.249053 O\n0.747952 0.747952 0.249053 O\n0.250711 0.250711 0.751196 O\n0.250711 0.749289 0.751196 O\n0.749289 0.250711 0.751196 O\n0.749289 0.749289 0.751196 O\n0.000000 0.261672 0.999811 O\n0.000000 0.738328 0.999811 O\n0.500000 0.285920 0.995204 O\n0.500000 0.714080 0.995204 O\n0.000000 0.253154 0.501311 O\n0.000000 0.746846 0.501311 O\n0.500000 0.251566 0.506314 O\n0.500000 0.748434 0.506314 O\n0.261672 0.000000 0.999811 O\n0.285920 0.500000 0.995204 O\n0.738328 0.000000 0.999811 O\n0.714080 0.500000 0.995204 O\n0.253154 0.000000 0.501311 O\n0.251566 0.500000 0.506314 O\n0.746846 0.000000 0.501311 O\n0.748434 0.500000 0.506314 O\n",
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],
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"volume": 612.3541142840394,
"volume_molar": 5.853464557434305,
"formula_full": "Li1 Mg30 B1 O31",
"formula_reduced": "LiMg30BO31",
"formula_anonymous": "ABC30D31",
"energy": -392.06732362,
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"updated_at": "2021-11-28T01:38:32.375000Z",
"spacegroup": 99
},
{
"id": "mp-1234089",
"created_at": "2022-09-04T14:48:10.255992Z",
"structure_string": "K2 Mg1 Nb2 P2 C2 O14\n1.0\n9.622433 0.334538 0.035631\n0.199267 6.771981 0.306346\n0.247916 0.248932 5.382988\nK Mg Nb P C O\n2 1 2 2 2 14\ndirect\n0.195570 0.475509 0.296919 K\n0.772369 0.927608 0.768841 K\n0.214911 0.978253 0.176245 Mg\n0.364590 0.775820 0.786156 Nb\n0.654100 0.271377 0.221401 Nb\n0.417590 0.271280 0.744918 P\n0.572199 0.771179 0.301928 P\n0.099067 0.775849 0.696689 C\n0.923122 0.202541 0.236124 C\n0.055382 0.163242 0.251661 O\n0.144503 0.794719 0.925930 O\n0.196946 0.818954 0.515859 O\n0.325722 0.096396 0.855870 O\n0.327763 0.466834 0.780131 O\n0.426061 0.795608 0.183759 O\n0.452502 0.251319 0.464358 O\n0.555433 0.759584 0.592306 O\n0.552437 0.266118 0.888701 O\n0.661684 0.948713 0.221074 O\n0.649061 0.577749 0.221198 O\n0.839712 0.212255 0.436168 O\n0.861803 0.237458 0.026956 O\n0.987473 0.709417 0.656809 O\n",
"nsites": 23,
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"elements": [
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"Mg",
"Nb",
"P",
"C",
"O"
],
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"density": 2.841327560218831,
"density_atomic": 0.06578081822549342,
"volume": 349.6460004671442,
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"formula_full": "K2 Mg1 Nb2 P2 C2 O14",
"formula_reduced": "K2MgNb2P2(CO7)2",
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"spacegroup": 1
},
{
"id": "mp-1233615",
"created_at": "2022-09-04T14:48:10.264228Z",
"structure_string": "Mg1 Si2 Ag8 O8\n1.0\n5.107323 0.000000 0.000000\n0.000000 7.711602 0.000000\n0.000000 0.000000 7.711602\nMg Si Ag O\n1 2 8 8\ndirect\n0.750000 0.750000 0.750000 Mg\n0.750000 0.250000 0.250000 Si\n0.250000 0.750000 0.750000 Si\n0.238426 0.156791 0.565875 Ag\n0.833667 0.626481 0.116380 Ag\n0.833667 0.873519 0.383620 Ag\n0.666333 0.383620 0.626481 Ag\n0.666333 0.116380 0.873519 Ag\n0.261574 0.565875 0.343209 Ag\n0.238426 0.343209 0.934125 Ag\n0.261574 0.934125 0.156791 Ag\n0.454878 0.591555 0.800702 O\n0.939969 0.317340 0.412481 O\n0.045122 0.800702 0.908445 O\n0.560031 0.412481 0.182660 O\n0.939969 0.182660 0.087519 O\n0.454878 0.908445 0.699298 O\n0.045122 0.699298 0.591555 O\n0.560031 0.087519 0.317340 O\n",
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"volume": 303.7263976346515,
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"formula_full": "Mg1 Si2 Ag8 O8",
"formula_reduced": "MgSi2(AgO)8",
"formula_anonymous": "AB2C8D8",
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"updated_at": "2021-11-28T01:38:28.222000Z",
"spacegroup": 81
},
{
"id": "mp-1046871",
"created_at": "2022-09-04T14:48:10.291767Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n0.000000 4.726955 4.726955\n4.726955 0.000000 4.726955\n4.726955 4.726955 0.000000\nZn Sb O\n2 4 8\ndirect\n0.750000 0.750000 0.750000 Zn\n0.500000 0.500000 0.500000 Zn\n0.125000 0.125000 0.625000 Sb\n0.625000 0.125000 0.125000 Sb\n0.125000 0.125000 0.125000 Sb\n0.125000 0.625000 0.125000 Sb\n0.877631 0.374123 0.374123 O\n0.374123 0.374123 0.877631 O\n0.374123 0.374123 0.374123 O\n0.372369 0.875877 0.875877 O\n0.875877 0.372369 0.875877 O\n0.875877 0.875877 0.372369 O\n0.374123 0.877631 0.374123 O\n0.875877 0.875877 0.875877 O\n",
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],
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"density": 5.863110178918666,
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"volume": 211.2391442006029,
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"formula_full": "Zn2 Sb4 O8",
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"formula_anonymous": "AB2C4",
"energy": -78.25993854,
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"spacegroup": 227
},
{
"id": "mp-720382",
"created_at": "2022-09-04T14:48:10.299890Z",
"structure_string": "H48 Cl8 O52\n1.0\n7.230289 0.000000 0.000000\n0.000000 11.174313 0.000000\n0.000000 9.069163 12.813468\nH Cl O\n48 8 52\ndirect\n0.573247 0.079606 0.886821 H\n0.073247 0.920394 0.613179 H\n0.426753 0.920394 0.113179 H\n0.926753 0.079606 0.386821 H\n0.917256 0.052220 0.558901 H\n0.417256 0.947780 0.941099 H\n0.082744 0.947780 0.441099 H\n0.582744 0.052220 0.058901 H\n0.910651 0.926502 0.690778 H\n0.410651 0.073498 0.809222 H\n0.089349 0.073498 0.309222 H\n0.589349 0.926502 0.190778 H\n0.649735 0.867556 0.766883 H\n0.149735 0.132444 0.733117 H\n0.350265 0.132444 0.233117 H\n0.850265 0.867556 0.266883 H\n0.801470 0.914840 0.814501 H\n0.301470 0.085160 0.685499 H\n0.198530 0.085160 0.185499 H\n0.698530 0.914840 0.314501 H\n0.821409 0.670166 0.871123 H\n0.321409 0.329834 0.628877 H\n0.178591 0.329834 0.128877 H\n0.678591 0.670166 0.371123 H\n0.763168 0.508601 0.888598 H\n0.263168 0.491399 0.611402 H\n0.236832 0.491399 0.111402 H\n0.736832 0.508601 0.388598 H\n0.984311 0.576377 0.868950 H\n0.484311 0.423623 0.631050 H\n0.015689 0.423623 0.131050 H\n0.515689 0.576377 0.368950 H\n0.593604 0.493178 0.792539 H\n0.093604 0.506822 0.707461 H\n0.406396 0.506822 0.207461 H\n0.906396 0.493178 0.292539 H\n0.507385 0.428514 0.903485 H\n0.007385 0.571486 0.596515 H\n0.492615 0.571486 0.096515 H\n0.992615 0.428514 0.403485 H\n0.667857 0.247125 0.917959 H\n0.167857 0.752875 0.582041 H\n0.332143 0.752875 0.082041 H\n0.832143 0.247125 0.417959 H\n0.814931 0.118542 0.962464 H\n0.314931 0.881458 0.537536 H\n0.185069 0.881458 0.037536 H\n0.685069 0.118542 0.462464 H\n0.667339 0.723227 0.594792 Cl\n0.167339 0.276773 0.905208 Cl\n0.332661 0.276773 0.405208 Cl\n0.832661 0.723227 0.094792 Cl\n0.806352 0.251138 0.670195 Cl\n0.306352 0.748862 0.829805 Cl\n0.193648 0.748862 0.329805 Cl\n0.693648 0.251138 0.170195 Cl\n0.761470 0.681944 0.533181 O\n0.261470 0.318056 0.966819 O\n0.238530 0.318056 0.466819 O\n0.738530 0.681944 0.033181 O\n0.580498 0.867058 0.524729 O\n0.080498 0.132942 0.975271 O\n0.419502 0.132942 0.475271 O\n0.919502 0.867058 0.024729 O\n0.521890 0.614412 0.659422 O\n0.021890 0.385588 0.840578 O\n0.478110 0.385588 0.340578 O\n0.978110 0.614412 0.159422 O\n0.798718 0.726821 0.663520 O\n0.298718 0.273179 0.836480 O\n0.201282 0.273179 0.336480 O\n0.701282 0.726821 0.163520 O\n0.938487 0.356437 0.593737 O\n0.438487 0.643563 0.906263 O\n0.061513 0.643563 0.406263 O\n0.561513 0.356437 0.093737 O\n0.909338 0.129862 0.762177 O\n0.409338 0.870138 0.737823 O\n0.090662 0.870138 0.237823 O\n0.590662 0.129862 0.262177 O\n0.692267 0.191292 0.627075 O\n0.192267 0.808708 0.872925 O\n0.307733 0.808708 0.372925 O\n0.807733 0.191292 0.127075 O\n0.688134 0.320812 0.706262 O\n0.188134 0.679188 0.793738 O\n0.311866 0.679188 0.293738 O\n0.811866 0.320812 0.206262 O\n0.997713 0.985513 0.625780 O\n0.497713 0.014487 0.874220 O\n0.002287 0.014487 0.374220 O\n0.502287 0.985513 0.125780 O\n0.783278 0.857687 0.785686 O\n0.283278 0.142313 0.714314 O\n0.216722 0.142313 0.214314 O\n0.716722 0.857687 0.285686 O\n0.863202 0.566584 0.902663 O\n0.363202 0.433416 0.597337 O\n0.136798 0.433416 0.097337 O\n0.636798 0.566584 0.402663 O\n0.623945 0.434923 0.868439 O\n0.123945 0.565077 0.631561 O\n0.376055 0.565077 0.131561 O\n0.876055 0.434923 0.368439 O\n0.680746 0.139265 0.953179 O\n0.180746 0.860735 0.546821 O\n0.319254 0.860735 0.046821 O\n0.819254 0.139265 0.453179 O\n",
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"formula_full": "H48 Cl8 O52",
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{
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"created_at": "2022-09-04T14:48:07.292560Z",
"structure_string": "Ba8 V4 O16\n1.0\n7.794917 0.000000 0.000000\n0.000000 6.260299 0.000000\n0.000000 5.439839 10.458101\nBa V O\n8 4 16\ndirect\n0.504862 0.022447 0.198199 Ba\n0.004862 0.977553 0.301801 Ba\n0.495138 0.977553 0.801801 Ba\n0.995138 0.022447 0.698199 Ba\n0.158574 0.311254 0.927118 Ba\n0.658574 0.688746 0.572882 Ba\n0.841426 0.688746 0.072882 Ba\n0.341426 0.311254 0.427118 Ba\n0.719847 0.341578 0.918064 V\n0.219847 0.658422 0.581936 V\n0.280153 0.658422 0.081936 V\n0.780153 0.341578 0.418064 V\n0.753395 0.665998 0.826193 O\n0.253395 0.334002 0.673807 O\n0.246605 0.334002 0.173807 O\n0.746605 0.665998 0.326193 O\n0.826797 0.141109 0.866574 O\n0.326797 0.858891 0.633426 O\n0.173203 0.858891 0.133426 O\n0.673203 0.141109 0.366574 O\n0.825158 0.256841 0.073234 O\n0.325158 0.743159 0.426766 O\n0.174842 0.743159 0.926766 O\n0.674842 0.256841 0.573234 O\n0.007112 0.280865 0.421641 O\n0.507112 0.719135 0.078359 O\n0.992888 0.719135 0.578359 O\n0.492888 0.280865 0.921641 O\n",
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{
"id": "mp-29339",
"created_at": "2022-09-04T14:48:07.302111Z",
"structure_string": "Lu1 Nb6 Cl18\n1.0\n8.948260 -4.751642 0.000000\n8.948260 4.751642 0.000000\n6.425077 0.000000 7.833763\nLu Nb Cl\n1 6 18\ndirect\n0.000000 0.000000 0.000000 Lu\n0.407535 0.298330 0.651307 Nb\n0.348693 0.592465 0.701670 Nb\n0.701670 0.348693 0.592465 Nb\n0.298330 0.651307 0.407535 Nb\n0.651307 0.407535 0.298330 Nb\n0.592465 0.701670 0.348693 Nb\n0.569149 0.160091 0.441549 Cl\n0.223420 0.369238 0.910696 Cl\n0.910696 0.223420 0.369238 Cl\n0.369238 0.910696 0.223420 Cl\n0.776580 0.630762 0.089304 Cl\n0.089304 0.776580 0.630762 Cl\n0.707338 0.959715 0.157136 Cl\n0.959715 0.157136 0.707338 Cl\n0.157136 0.707338 0.959715 Cl\n0.292662 0.040285 0.842864 Cl\n0.040285 0.842864 0.292662 Cl\n0.842864 0.292662 0.040285 Cl\n0.558451 0.430851 0.839909 Cl\n0.160091 0.441549 0.569149 Cl\n0.441549 0.569149 0.160091 Cl\n0.430851 0.839909 0.558451 Cl\n0.839909 0.558451 0.430851 Cl\n0.630762 0.089304 0.776580 Cl\n",
"nsites": 25,
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},
{
"id": "mp-1183428",
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"elements": [
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],
"chemical_system": "Be-Ga",
"density": 5.72121687667725,
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"volume": 63.32540508731407,
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"formula_full": "Be1 Ga3",
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"updated_at": "2021-11-28T01:38:24.622000Z",
"spacegroup": 139
},
{
"id": "mp-1219746",
"created_at": "2022-09-04T14:48:07.323897Z",
"structure_string": "Sc12 Zn72\n1.0\n-6.881789 6.920485 7.008800\n6.881789 -6.920485 7.008800\n6.881789 6.920485 -7.008800\nSc Zn\n12 72\ndirect\n0.192030 0.893902 0.701871 Sc\n0.807970 0.106098 0.298129 Sc\n0.192030 0.490159 0.298129 Sc\n0.807970 0.509841 0.701871 Sc\n0.699299 0.189417 0.888716 Sc\n0.300701 0.810583 0.111284 Sc\n0.300701 0.189417 0.490118 Sc\n0.699299 0.810583 0.509882 Sc\n0.890807 0.698215 0.192592 Sc\n0.109193 0.301785 0.807408 Sc\n0.494377 0.301785 0.192592 Sc\n0.505623 0.698215 0.807408 Sc\n0.189377 0.500000 0.689377 Zn\n0.810623 0.500000 0.310623 Zn\n0.692244 0.192244 0.500000 Zn\n0.307756 0.807756 0.500000 Zn\n0.500000 0.691306 0.191306 Zn\n0.500000 0.308694 0.808694 Zn\n0.462532 0.141752 0.918559 Zn\n0.776807 0.858248 0.320780 Zn\n0.223193 0.543973 0.081441 Zn\n0.537468 0.456027 0.679220 Zn\n0.918261 0.458127 0.141639 Zn\n0.316488 0.776622 0.858361 Zn\n0.081739 0.223378 0.539866 Zn\n0.683512 0.541873 0.460134 Zn\n0.140730 0.916534 0.457557 Zn\n0.859270 0.316827 0.775803 Zn\n0.541024 0.083466 0.224197 Zn\n0.458976 0.683173 0.542443 Zn\n0.537468 0.858248 0.081441 Zn\n0.223193 0.141752 0.679220 Zn\n0.776807 0.456027 0.918559 Zn\n0.462532 0.543973 0.320780 Zn\n0.081739 0.541873 0.858361 Zn\n0.683512 0.223378 0.141639 Zn\n0.918261 0.776622 0.460134 Zn\n0.316488 0.458127 0.539866 Zn\n0.859270 0.083466 0.542443 Zn\n0.140730 0.683173 0.224197 Zn\n0.458976 0.916534 0.775803 Zn\n0.541024 0.316827 0.457557 Zn\n0.256656 0.163137 0.906481 Zn\n0.743344 0.836863 0.093519 Zn\n0.256656 0.350176 0.093519 Zn\n0.743344 0.649824 0.906481 Zn\n0.906068 0.239522 0.145589 Zn\n0.093932 0.760478 0.854411 Zn\n0.093932 0.239522 0.333454 Zn\n0.906068 0.760478 0.666546 Zn\n0.144297 0.909220 0.235077 Zn\n0.855703 0.090780 0.764923 Zn\n0.325856 0.090780 0.235077 Zn\n0.674144 0.909220 0.764923 Zn\n0.324372 0.001300 0.001071 Zn\n0.999771 0.998700 0.323072 Zn\n0.000229 0.323301 0.998929 Zn\n0.675628 0.676699 0.676928 Zn\n0.675628 0.998700 0.998929 Zn\n0.000229 0.001300 0.676928 Zn\n0.999771 0.676699 0.001071 Zn\n0.324372 0.323301 0.323072 Zn\n0.404200 0.057064 0.652863 Zn\n0.595800 0.942936 0.347137 Zn\n0.404200 0.751337 0.347137 Zn\n0.595800 0.248663 0.652863 Zn\n0.654111 0.404428 0.058539 Zn\n0.345889 0.595572 0.941461 Zn\n0.345889 0.404428 0.750316 Zn\n0.654111 0.595572 0.249684 Zn\n0.058095 0.652921 0.405174 Zn\n0.941905 0.347079 0.594826 Zn\n0.752253 0.347079 0.405174 Zn\n0.247747 0.652921 0.594826 Zn\n0.406265 0.000000 0.406265 Zn\n0.593735 0.000000 0.593735 Zn\n0.410041 0.410041 0.000000 Zn\n0.589959 0.589959 0.000000 Zn\n0.000000 0.405121 0.405121 Zn\n0.000000 0.594879 0.594879 Zn\n0.084357 0.993979 0.909622 Zn\n0.915643 0.006021 0.090378 Zn\n0.084357 0.174736 0.090378 Zn\n0.915643 0.825264 0.909622 Zn\n",
"nsites": 84,
"nelements": 2,
"elements": [
"Sc",
"Zn"
],
"chemical_system": "Sc-Zn",
"density": 6.527959038740645,
"density_atomic": 0.06291261583088488,
"volume": 1335.1853025122978,
"volume_molar": 9.572230752871715,
"formula_full": "Sc12 Zn72",
"formula_reduced": "ScZn6",
"formula_anonymous": "AB6",
"energy": -186.3651867,
"energy_per_atom": -2.218633175,
"energy_above_hull": null,
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"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -186.3651867,
"band_gap": 0.0,
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"is_magnetic": false,
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"updated_at": "2021-11-28T01:38:30.645000Z",
"spacegroup": 71
},
{
"id": "mp-6391",
"created_at": "2022-09-04T14:48:07.338973Z",
"structure_string": "Na4 Zn2 Si2 O8\n1.0\n5.547059 0.000000 0.000000\n0.000000 5.338375 0.000000\n0.000000 5.306326 7.044047\nNa Zn Si O\n4 2 2 8\ndirect\n0.672518 0.735987 0.252802 Na\n0.817951 0.484779 0.008021 Na\n0.327482 0.735987 0.752802 Na\n0.182049 0.484779 0.508021 Na\n0.811687 0.998740 0.502139 Zn\n0.188313 0.998740 0.002139 Zn\n0.688325 0.249303 0.754772 Si\n0.311675 0.249303 0.254772 Si\n0.208353 0.305434 0.060612 O\n0.791647 0.305434 0.560612 O\n0.157472 0.975961 0.447063 O\n0.842528 0.975961 0.947063 O\n0.289831 0.582986 0.227915 O\n0.401106 0.142709 0.782177 O\n0.598894 0.142709 0.282177 O\n0.710169 0.582986 0.727915 O\n",
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"elements": [
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"Si",
"O"
],
"chemical_system": "Na-O-Si-Zn",
"density": 3.2395811804111125,
"density_atomic": 0.07670538859054497,
"volume": 208.59029976900771,
"volume_molar": 7.851000914872249,
"formula_full": "Na4 Zn2 Si2 O8",
"formula_reduced": "Na2ZnSiO4",
"formula_anonymous": "ABC2D4",
"energy": -98.12277559,
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"updated_at": "2021-11-28T01:38:30.538000Z",
"spacegroup": 7
},
{
"id": "mp-755672",
"created_at": "2022-09-04T14:48:07.362792Z",
"structure_string": "Li4 Ni5 Sn1 O12\n1.0\n4.346282 2.560671 0.000000\n-4.346282 2.560671 0.000000\n0.000000 0.307755 10.039226\nLi Ni Sn O\n4 5 1 12\ndirect\n0.655761 0.152341 0.747455 Li\n0.847659 0.344239 0.252545 Li\n0.152341 0.655761 0.747455 Li\n0.344239 0.847659 0.252545 Li\n0.837618 0.162382 0.500000 Ni\n0.335981 0.664019 0.000000 Ni\n0.664019 0.335981 0.000000 Ni\n0.162382 0.837618 0.500000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Sn\n0.667466 0.028285 0.112099 O\n0.971715 0.332534 0.887901 O\n0.505890 0.142857 0.398455 O\n0.142857 0.505890 0.398455 O\n0.857143 0.494110 0.601545 O\n0.137288 0.137288 0.596658 O\n0.494110 0.857143 0.601545 O\n0.028285 0.667466 0.112099 O\n0.350250 0.350250 0.102246 O\n0.332534 0.971715 0.887901 O\n0.649750 0.649750 0.897754 O\n0.862712 0.862712 0.403342 O\n",
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"elements": [
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],
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"formula_full": "Li4 Ni5 Sn1 O12",
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"updated_at": "2021-11-28T01:38:27.054000Z",
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},
{
"id": "mp-634859",
"created_at": "2022-09-04T14:48:07.700905Z",
"structure_string": "Ca1 O2\n1.0\n-1.648015 1.648015 3.496542\n1.648015 -1.648015 3.496542\n1.648015 1.648015 -3.496542\nCa O\n1 2\ndirect\n0.500000 0.500000 0.000000 Ca\n0.891363 0.891363 0.000000 O\n0.108637 0.108637 0.000000 O\n",
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"elements": [
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"O"
],
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"density": 3.150819563132524,
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"volume": 37.98578109516481,
"volume_molar": 7.625190687787648,
"formula_full": "Ca1 O2",
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"updated_at": "2021-11-28T01:38:27.917000Z",
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}
]
}