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{
"id": "mp-1184567",
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{
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{
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"created_at": "2022-09-04T14:40:17.606442Z",
"structure_string": "Ni10 Ge6\n1.0\n3.360712 5.409949 0.000000\n-3.360712 5.409949 0.000000\n0.000000 3.268091 5.443580\nNi Ge\n10 6\ndirect\n0.671166 0.183408 0.145190 Ni\n0.816592 0.328834 0.354810 Ni\n0.328834 0.816592 0.854810 Ni\n0.183408 0.671166 0.645190 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.737701 0.913376 0.583983 Ni\n0.086624 0.262299 0.916017 Ni\n0.262299 0.086624 0.416017 Ni\n0.913376 0.737701 0.083983 Ni\n0.895703 0.104297 0.750000 Ge\n0.104297 0.895703 0.250000 Ge\n0.582740 0.714647 0.453334 Ge\n0.285353 0.417260 0.046666 Ge\n0.417260 0.285353 0.546666 Ge\n0.714647 0.582740 0.953334 Ge\n",
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{
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{
"id": "mp-675724",
"created_at": "2022-09-04T14:40:19.483863Z",
"structure_string": "Bi4 Te4 O16\n1.0\n7.464321 0.000000 0.000000\n3.675078 6.752688 0.000000\n3.116588 0.736701 7.645552\nBi Te O\n4 4 16\ndirect\n0.278543 0.869480 0.748054 Bi\n0.493721 0.966778 0.095363 Bi\n0.728123 0.347508 0.775027 Bi\n0.773818 0.980279 0.483889 Bi\n0.924364 0.329789 0.094341 Te\n0.214710 0.453882 0.671445 Te\n0.686714 0.628652 0.397847 Te\n0.268060 0.526696 0.181223 Te\n0.814174 0.023505 0.843392 O\n0.704551 0.293745 0.052424 O\n0.973368 0.672815 0.191645 O\n0.553290 0.922504 0.347211 O\n0.119192 0.529080 0.474585 O\n0.624164 0.778569 0.669802 O\n0.390545 0.653448 0.545161 O\n0.360704 0.584213 0.915627 O\n0.640714 0.619977 0.184394 O\n0.838940 0.267628 0.339271 O\n0.270935 0.278467 0.158322 O\n0.065296 0.271147 0.760476 O\n0.491953 0.229779 0.634358 O\n0.946021 0.929199 0.679213 O\n0.201875 0.899959 0.205721 O\n0.136225 0.022703 0.051210 O\n",
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{
"id": "mp-554151",
"created_at": "2022-09-04T14:40:24.201908Z",
"structure_string": "Si4 O8\n1.0\n-4.395674 4.395674 2.510795\n4.395674 -4.395674 2.510795\n4.395674 4.395674 -2.510795\nSi O\n4 8\ndirect\n0.591752 0.093867 0.147967 Si\n0.906133 0.054100 0.497885 Si\n0.556216 0.408248 0.502115 Si\n0.945900 0.443784 0.852033 Si\n0.242497 0.811695 0.977196 O\n0.734698 0.757503 0.569198 O\n0.188305 0.165501 0.430802 O\n0.666519 0.365589 0.707606 O\n0.657983 0.958913 0.292394 O\n0.634411 0.342017 0.300930 O\n0.834499 0.265302 0.022804 O\n0.041087 0.333481 0.699070 O\n",
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"formula_full": "Si4 O8",
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{
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"created_at": "2022-09-04T14:39:59.270866Z",
"structure_string": "Sc8 Pt4\n1.0\n4.520374 0.000000 0.000000\n0.000000 6.624348 0.000000\n0.000000 0.000000 8.254140\nSc Pt\n8 4\ndirect\n0.250000 0.987158 0.326137 Sc\n0.750000 0.012842 0.673863 Sc\n0.250000 0.487158 0.173863 Sc\n0.750000 0.512842 0.826137 Sc\n0.750000 0.648105 0.423115 Sc\n0.250000 0.351895 0.576885 Sc\n0.750000 0.148105 0.076885 Sc\n0.250000 0.851895 0.923115 Sc\n0.250000 0.259240 0.902653 Pt\n0.750000 0.740760 0.097347 Pt\n0.250000 0.759240 0.597347 Pt\n0.750000 0.240760 0.402653 Pt\n",
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{
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{
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{
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{
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"structure_string": "Mg2 V4 O8\n1.0\n-3.030340 5.250299 0.004761\n3.021784 1.749667 4.936998\n6.034812 -0.015057 0.010773\nMg V O\n2 4 8\ndirect\n0.625007 0.624989 0.750006 Mg\n0.124999 0.624991 0.750005 Mg\n0.624987 0.625044 0.249955 V\n0.994713 0.004370 0.990064 V\n0.255285 0.245638 0.509934 V\n0.624995 0.124991 0.250010 V\n0.388570 0.372575 0.776900 O\n0.387569 0.850379 0.774867 O\n0.862427 0.399621 0.725125 O\n0.861437 0.877412 0.723113 O\n0.856918 0.379335 0.242926 O\n0.384893 0.379063 0.242774 O\n0.865114 0.870932 0.257235 O\n0.393084 0.870660 0.257085 O\n",
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{
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"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.8120476,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:53.046000Z",
"spacegroup": 191
}
]
}