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{
"id": "mp-770192",
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{
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{
"id": "mp-1174346",
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"structure_string": "Li10 Mn4 Co2 O16\n1.0\n2.872680 0.191638 0.030452\n-0.390542 5.866878 0.073431\n-0.173517 0.048065 16.305278\nLi Mn Co O\n10 4 2 16\ndirect\n0.499998 0.249932 0.124985 Li\n0.499995 0.250079 0.625024 Li\n0.499996 0.750011 0.374989 Li\n0.499996 0.750023 0.874990 Li\n0.499998 0.749900 0.124997 Li\n0.499998 0.750114 0.625018 Li\n0.998911 0.508714 0.010238 Li\n0.998922 0.508865 0.510280 Li\n0.001068 0.991137 0.239733 Li\n0.001073 0.991325 0.739774 Li\n0.000705 0.999387 0.503584 Mn\n0.999297 0.500601 0.246421 Mn\n0.000677 0.999116 0.003548 Mn\n0.999342 0.500880 0.746453 Mn\n0.499994 0.250001 0.375002 Co\n0.499999 0.250021 0.875002 Co\n0.500182 0.229955 0.993652 O\n0.500179 0.230163 0.493664 O\n0.499807 0.269817 0.256364 O\n0.499831 0.270038 0.756374 O\n0.000274 0.003649 0.114800 O\n0.000286 0.003868 0.614841 O\n0.999742 0.496077 0.135169 O\n0.999750 0.496295 0.635208 O\n0.999759 0.472513 0.370663 O\n0.999758 0.472573 0.870689 O\n0.000226 0.027490 0.379315 O\n0.000235 0.027472 0.879287 O\n0.499499 0.720102 0.252237 O\n0.499534 0.720329 0.752271 O\n0.500490 0.779888 0.497730 O\n0.500482 0.779662 0.997697 O\n",
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"formula_full": "Li10 Mn4 Co2 O16",
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{
"id": "mp-1175451",
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"formula_full": "Li9 Co7 O16",
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{
"id": "mp-764733",
"created_at": "2022-09-04T14:47:36.513590Z",
"structure_string": "Li5 Ni5 O9 F1\n1.0\n4.983312 0.000000 0.000000\n-1.642827 5.550709 0.000000\n-0.946716 -1.818167 6.236410\nLi Ni O F\n5 5 9 1\ndirect\n0.794546 0.101305 0.598277 Li\n0.616788 0.702401 0.204890 Li\n0.398187 0.302220 0.800818 Li\n0.195326 0.902389 0.403006 Li\n0.993696 0.490470 0.998632 Li\n0.802241 0.602283 0.599375 Ni\n0.606071 0.208606 0.199516 Ni\n0.401977 0.802728 0.792157 Ni\n0.203614 0.401368 0.396350 Ni\n0.990459 0.002498 0.000533 Ni\n0.911357 0.057097 0.282727 O\n0.924377 0.543058 0.312223 O\n0.672410 0.128508 0.896262 O\n0.700995 0.677623 0.897847 O\n0.492766 0.272118 0.491728 O\n0.517984 0.734394 0.502928 O\n0.276022 0.321099 0.098481 O\n0.101823 0.477674 0.691770 O\n0.099472 0.936887 0.724409 O\n0.299889 0.835277 0.108073 F\n",
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{
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"structure_string": "Li2 V1 N2\n1.0\n3.005835 -0.000175 0.000158\n-1.503069 2.603356 -0.000050\n0.000254 0.000042 5.511240\nLi V N\n2 1 2\ndirect\n0.666683 0.333340 0.361297 Li\n0.333317 0.666660 0.638703 Li\n0.000000 0.000000 0.000000 V\n0.666697 0.333360 0.792455 N\n0.333303 0.666640 0.207545 N\n",
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{
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{
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"structure_string": "Li4 Mg1 H3 N3\n1.0\n0.000000 3.689450 0.000000\n0.000000 0.000000 4.803923\n5.352113 -1.844725 -2.401961\nLi Mg H N\n4 1 3 3\ndirect\n0.672069 0.670707 0.344138 Li\n0.327931 0.326569 0.655862 Li\n0.319167 0.818207 0.638334 Li\n0.680833 0.179873 0.361666 Li\n0.000000 0.474915 0.000000 Mg\n0.500000 0.058974 0.000000 H\n0.106720 0.009121 0.213440 H\n0.893280 0.795681 0.786560 H\n0.500000 0.273078 0.000000 N\n0.167248 0.901685 0.334496 N\n0.832752 0.567190 0.665504 N\n",
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{
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{
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"structure_string": "Li18 Cr6 O24\n1.0\n5.787737 0.000000 0.000000\n0.000000 5.805351 0.000000\n0.000000 2.738098 12.318740\nLi Cr O\n18 6 24\ndirect\n0.498068 0.000000 0.000000 Li\n0.977086 0.000000 0.000000 Li\n0.216268 0.000000 0.500000 Li\n0.712666 0.000000 0.500000 Li\n0.734603 0.165136 0.167913 Li\n0.222889 0.175863 0.158326 Li\n0.959122 0.337862 0.332242 Li\n0.962652 0.154242 0.666337 Li\n0.470078 0.500000 0.000000 Li\n0.466611 0.172172 0.662224 Li\n0.723044 0.334872 0.830494 Li\n0.212584 0.500000 0.500000 Li\n0.723044 0.665128 0.169506 Li\n0.466611 0.827828 0.337776 Li\n0.962652 0.845758 0.333663 Li\n0.959122 0.662138 0.667758 Li\n0.222889 0.824137 0.841674 Li\n0.734603 0.834864 0.832087 Li\n0.458705 0.305736 0.331466 Cr\n0.945784 0.500000 0.000000 Cr\n0.222972 0.304063 0.832320 Cr\n0.735630 0.500000 0.500000 Cr\n0.222972 0.695937 0.167680 Cr\n0.458705 0.694264 0.668534 Cr\n0.694139 0.105121 0.328654 O\n0.742233 0.268731 0.004759 O\n0.234160 0.102670 0.337907 O\n0.461333 0.426913 0.180567 O\n0.989863 0.102791 0.828879 O\n0.940189 0.270213 0.504653 O\n0.992000 0.434805 0.153411 O\n0.448818 0.102056 0.838828 O\n0.470546 0.275111 0.486915 O\n0.210797 0.722553 0.013180 O\n0.688662 0.564573 0.346684 O\n0.221477 0.574490 0.318765 O\n0.221477 0.425510 0.681235 O\n0.688662 0.435427 0.653316 O\n0.210797 0.277447 0.986820 O\n0.470546 0.724889 0.513085 O\n0.448818 0.897944 0.161172 O\n0.992000 0.565195 0.846589 O\n0.940189 0.729787 0.495347 O\n0.989863 0.897209 0.171121 O\n0.461333 0.573087 0.819433 O\n0.234160 0.897330 0.662093 O\n0.742233 0.731269 0.995241 O\n0.694139 0.894879 0.671346 O\n",
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},
{
"id": "mp-1194536",
"created_at": "2022-09-04T14:46:24.293264Z",
"structure_string": "Ga2 Ni18 B16\n1.0\n3.557705 -4.060566 0.000000\n3.557705 4.060566 0.000000\n0.000000 0.000000 10.744282\nGa Ni B\n2 18 16\ndirect\n0.914462 0.085538 0.750000 Ga\n0.085538 0.914462 0.250000 Ga\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.710208 0.289792 0.919131 Ni\n0.289792 0.710208 0.080869 Ni\n0.710208 0.289792 0.580869 Ni\n0.289792 0.710208 0.419131 Ni\n0.397169 0.051790 0.750000 Ni\n0.051790 0.397169 0.250000 Ni\n0.602831 0.948210 0.250000 Ni\n0.948210 0.602831 0.750000 Ni\n0.622085 0.759427 0.885962 Ni\n0.759427 0.622085 0.114038 Ni\n0.622085 0.759427 0.614038 Ni\n0.759427 0.622085 0.385962 Ni\n0.377915 0.240573 0.114038 Ni\n0.240573 0.377915 0.885962 Ni\n0.377915 0.240573 0.385962 Ni\n0.240573 0.377915 0.614038 Ni\n0.564578 0.435422 0.750000 B\n0.435422 0.564578 0.250000 B\n0.351579 0.648421 0.750000 B\n0.648421 0.351579 0.250000 B\n0.779121 0.220879 0.380208 B\n0.220879 0.779121 0.619792 B\n0.779121 0.220879 0.119792 B\n0.220879 0.779121 0.880208 B\n0.383007 0.039877 0.948871 B\n0.039877 0.383007 0.051129 B\n0.383007 0.039877 0.551129 B\n0.039877 0.383007 0.448871 B\n0.616993 0.960123 0.051129 B\n0.960123 0.616993 0.948871 B\n0.616993 0.960123 0.448871 B\n0.960123 0.616993 0.551129 B\n",
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"elements": [
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],
"chemical_system": "B-Ga-Ni",
"density": 7.322475613360831,
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"volume": 310.43015532153464,
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"formula_full": "Ga2 Ni18 B16",
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"updated_at": "2021-11-28T01:37:31.604000Z",
"spacegroup": 63
},
{
"id": "mp-1222534",
"created_at": "2022-09-04T14:47:01.483625Z",
"structure_string": "Li4 Al1 Ni3 O8\n1.0\n19.230478 -1.439773 0.000000\n19.230478 1.439773 0.000000\n19.122683 0.000000 2.491429\nLi Al Ni O\n4 1 3 8\ndirect\n0.625285 0.625285 0.625285 Li\n0.875048 0.875048 0.875048 Li\n0.374715 0.374715 0.374715 Li\n0.124952 0.124952 0.124952 Li\n0.000000 0.000000 0.000000 Al\n0.749922 0.749922 0.749922 Ni\n0.500000 0.500000 0.500000 Ni\n0.250078 0.250078 0.250078 Ni\n0.935533 0.935533 0.935533 O\n0.185593 0.185593 0.185593 O\n0.684168 0.684168 0.684168 O\n0.435672 0.435672 0.435672 O\n0.315832 0.315832 0.315832 O\n0.564328 0.564328 0.564328 O\n0.064467 0.064467 0.064467 O\n0.814407 0.814407 0.814407 O\n",
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],
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"formula_full": "Li4 Al1 Ni3 O8",
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}
]
}