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{
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{
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"formula_full": "Sr4 Fe2 W2 O12",
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{
"id": "mp-1278360",
"created_at": "2022-09-04T14:43:49.459431Z",
"structure_string": "Sr4 Fe2 W2 O12\n1.0\n4.928088 0.035277 2.879427\n-1.603819 4.659358 2.879693\n-3.284758 -4.636994 5.671979\nSr Fe W O\n4 2 2 12\ndirect\n0.499435 0.998592 0.741672 Sr\n0.999004 0.499743 0.258750 Sr\n0.001063 0.500259 0.741274 Sr\n0.500629 0.001395 0.258348 Sr\n0.499407 0.499820 0.999869 Fe\n0.000034 0.999998 0.499984 Fe\n0.000069 0.000056 0.000015 W\n0.500068 0.500038 0.500027 W\n0.242561 0.241120 0.000212 O\n0.750602 0.747305 0.500256 O\n0.249425 0.252708 0.499771 O\n0.757469 0.758871 0.999789 O\n0.459246 0.540474 0.754301 O\n0.955806 0.044007 0.235068 O\n0.044250 0.956039 0.764913 O\n0.540808 0.459541 0.245732 O\n0.263952 0.739010 0.460717 O\n0.757331 0.243863 0.955820 O\n0.242700 0.756137 0.044182 O\n0.736142 0.261019 0.539298 O\n",
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},
{
"id": "mp-1272760",
"created_at": "2022-09-04T14:40:32.069865Z",
"structure_string": "Sr4 Fe2 W2 O12\n1.0\n4.949621 0.064376 2.919164\n-1.631009 4.627070 -2.828816\n-6.482713 4.696345 5.747060\nSr Fe W O\n4 2 2 12\ndirect\n0.627959 0.374135 0.876809 Sr\n0.121954 0.875972 0.373537 Sr\n0.377936 0.624029 0.126425 Sr\n0.872100 0.125845 0.623225 Sr\n0.750043 0.250069 0.249987 Fe\n0.250072 0.749974 0.750021 Fe\n0.497002 0.502184 0.501303 W\n0.003019 0.997808 0.998698 W\n0.359005 0.113839 0.116733 O\n0.852988 0.626165 0.618598 O\n0.647049 0.873877 0.881392 O\n0.140947 0.386093 0.383300 O\n0.858141 0.658757 0.143817 O\n0.356227 0.173426 0.645438 O\n0.143810 0.326595 0.854596 O\n0.641776 0.841227 0.356145 O\n0.400205 0.699459 0.595069 O\n0.909677 0.186422 0.095283 O\n0.590279 0.313512 0.404727 O\n0.099811 0.800615 0.904896 O\n",
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{
"id": "mp-19266",
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"structure_string": "Sr4 Fe2 W2 O12\n1.0\n5.742706 -0.005573 -0.008057\n-0.005443 5.758747 -0.009541\n-0.011427 -0.010996 8.010450\nSr Fe W O\n4 2 2 12\ndirect\n0.973039 0.004048 0.752285 Sr\n0.471731 0.495151 0.749559 Sr\n0.528291 0.504812 0.250443 Sr\n0.026965 0.995943 0.247713 Sr\n0.000005 0.499984 0.499981 Fe\n0.499898 0.000212 0.000014 Fe\n0.000020 0.499978 0.999943 W\n0.500060 0.000030 0.500006 W\n0.709266 0.264572 0.534073 O\n0.207844 0.235285 0.966048 O\n0.290726 0.735386 0.465916 O\n0.792147 0.764700 0.033973 O\n0.767304 0.795332 0.467130 O\n0.267957 0.704934 0.033763 O\n0.232694 0.204646 0.532866 O\n0.732043 0.295044 0.966261 O\n0.509248 0.936709 0.740503 O\n0.008662 0.564090 0.760406 O\n0.490744 0.063259 0.259504 O\n0.991356 0.435885 0.239613 O\n",
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{
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"structure_string": "Sr4 Fe3 Cl1 O8\n1.0\n3.970611 0.000000 0.000000\n0.000000 3.970611 0.000000\n0.000000 0.000000 15.643036\nSr Fe Cl O\n4 3 1 8\ndirect\n0.000000 0.000000 0.612003 Sr\n0.000000 0.000000 0.124518 Sr\n0.000000 0.000000 0.387997 Sr\n0.000000 0.000000 0.875482 Sr\n0.500000 0.500000 0.753738 Fe\n0.500000 0.500000 0.246262 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Cl\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.634850 O\n0.000000 0.500000 0.787899 O\n0.500000 0.500000 0.365150 O\n0.500000 0.000000 0.212101 O\n0.000000 0.500000 0.500000 O\n0.000000 0.500000 0.212101 O\n0.500000 0.000000 0.787899 O\n",
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{
"id": "mp-1218513",
"created_at": "2022-09-04T14:46:18.967220Z",
"structure_string": "Sr4 Fe3 Mo1 O12\n1.0\n-3.969645 3.969645 3.969645\n3.969645 -3.969645 3.969645\n3.969645 3.969645 -3.969645\nSr Fe Mo O\n4 3 1 12\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Mo\n0.242540 0.242540 0.000000 O\n0.757460 0.757460 0.000000 O\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n0.500000 0.250000 0.750000 O\n0.000000 0.757460 0.757460 O\n0.000000 0.242540 0.242540 O\n0.500000 0.750000 0.250000 O\n0.250000 0.500000 0.750000 O\n0.757460 0.000000 0.757460 O\n0.750000 0.500000 0.250000 O\n0.242540 0.000000 0.242540 O\n",
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{
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"structure_string": "Sr4 Fe3 Mo1 O12\n1.0\n5.600608 0.000000 0.000000\n0.000000 5.600608 0.000000\n0.000000 0.000000 7.998038\nSr Fe Mo O\n4 3 1 12\ndirect\n0.500000 0.000000 0.733639 Sr\n0.000000 0.500000 0.266361 Sr\n0.500000 0.000000 0.266361 Sr\n0.000000 0.500000 0.733639 Sr\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Mo\n0.000000 0.000000 0.757874 O\n0.500000 0.500000 0.249743 O\n0.754602 0.754602 0.500000 O\n0.244297 0.244297 0.000000 O\n0.754602 0.245398 0.500000 O\n0.244297 0.755703 0.000000 O\n0.000000 0.000000 0.242126 O\n0.500000 0.500000 0.750257 O\n0.245398 0.245398 0.500000 O\n0.755703 0.755703 0.000000 O\n0.245398 0.754602 0.500000 O\n0.755703 0.244297 0.000000 O\n",
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{
"id": "mp-1218774",
"created_at": "2022-09-04T14:48:19.269373Z",
"structure_string": "Sr4 Fe4 Bi5 Pb1 O18\n1.0\n2.736239 -15.640949 0.000000\n2.736239 15.640949 0.000000\n0.000000 0.000000 5.472183\nSr Fe Bi Pb O\n4 4 5 1 18\ndirect\n0.379618 0.620382 0.500000 Sr\n0.879243 0.120757 0.000000 Sr\n0.122001 0.877999 0.000000 Sr\n0.622108 0.377892 0.500000 Sr\n0.563436 0.436564 0.000000 Fe\n0.066477 0.933523 0.500000 Fe\n0.937616 0.062384 0.500000 Fe\n0.436526 0.563474 0.000000 Fe\n0.706621 0.293379 0.000000 Bi\n0.294024 0.705976 0.000000 Bi\n0.793943 0.206057 0.500000 Bi\n0.001046 0.998954 0.000000 Bi\n0.502877 0.497123 0.500000 Bi\n0.206581 0.793419 0.500000 Pb\n0.637194 0.362806 0.000000 O\n0.132456 0.867544 0.500000 O\n0.862338 0.137662 0.500000 O\n0.362678 0.637322 0.000000 O\n0.499934 0.500066 0.000000 O\n0.000809 0.999191 0.500000 O\n0.811129 0.685383 0.750521 O\n0.314617 0.188871 0.249479 O\n0.314617 0.188871 0.750521 O\n0.811129 0.685383 0.249479 O\n0.686153 0.815448 0.750755 O\n0.184552 0.313847 0.249245 O\n0.184552 0.313847 0.750755 O\n0.686153 0.815448 0.249245 O\n0.794525 0.205475 0.000000 O\n0.296820 0.703180 0.500000 O\n0.704024 0.295976 0.500000 O\n0.204201 0.795799 0.000000 O\n",
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},
{
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"structure_string": "Sr4 Fe4 O10\n1.0\n-2.800831 2.889148 7.865144\n2.800831 -2.889148 7.865144\n2.800831 2.889148 -7.865144\nSr Fe O\n4 4 10\ndirect\n0.128083 0.612538 0.523761 Sr\n0.871917 0.395678 0.484455 Sr\n0.588777 0.112538 0.484455 Sr\n0.411223 0.895678 0.523761 Sr\n0.000000 0.999026 0.999026 Fe\n0.500000 0.499026 0.999026 Fe\n0.178083 0.293349 0.971432 Fe\n0.821917 0.793349 0.115266 Fe\n0.244554 0.742336 0.003000 O\n0.755446 0.758446 0.497782 O\n0.239336 0.242336 0.497782 O\n0.760664 0.258446 0.003000 O\n0.189181 0.124295 0.033049 O\n0.810819 0.843868 0.935114 O\n0.591245 0.624295 0.935114 O\n0.408755 0.343868 0.033049 O\n0.121096 0.637284 0.258381 O\n0.878904 0.137284 0.516188 O\n",
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},
{
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"created_at": "2022-09-04T14:46:09.750220Z",
"structure_string": "Sr4 Fe4 O10\n1.0\n7.909518 3.968488 0.000000\n-7.909518 3.968488 0.000000\n0.000000 3.919999 4.049479\nSr Fe O\n4 4 10\ndirect\n0.411822 0.126288 0.965407 Sr\n0.588178 0.873712 0.034593 Sr\n0.873712 0.588178 0.034593 Sr\n0.126288 0.411822 0.965407 Sr\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.814121 0.814121 0.512082 Fe\n0.185879 0.185879 0.487918 Fe\n0.754057 0.245943 0.000000 O\n0.241212 0.758788 0.500000 O\n0.758788 0.241212 0.500000 O\n0.245943 0.754057 0.000000 O\n0.396361 0.177573 0.475962 O\n0.603639 0.822427 0.524038 O\n0.822427 0.603639 0.524038 O\n0.177573 0.396361 0.475962 O\n0.844719 0.844719 0.830569 O\n0.155281 0.155281 0.169431 O\n",
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"nelements": 3,
"elements": [
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"O"
],
"chemical_system": "Fe-O-Sr",
"density": 4.793519807849524,
"density_atomic": 0.07080570774520409,
"volume": 254.21679371913632,
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"formula_full": "Sr4 Fe4 O10",
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"updated_at": "2021-11-28T01:37:21.719000Z",
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},
{
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"structure_string": "Sr4 Fe4 O11\n1.0\n3.910468 -5.567511 0.000000\n3.910468 5.567511 0.000000\n0.000000 0.000000 5.543302\nSr Fe O\n4 4 11\ndirect\n0.258431 0.741569 0.000000 Sr\n0.741569 0.258431 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.745602 0.745602 0.000000 Fe\n0.254398 0.254398 0.000000 Fe\n0.098922 0.341413 0.240097 O\n0.901078 0.658587 0.240097 O\n0.341413 0.098922 0.759903 O\n0.658587 0.901078 0.759903 O\n0.901078 0.658587 0.759903 O\n0.098922 0.341413 0.759903 O\n0.658587 0.901078 0.240097 O\n0.341413 0.098922 0.240097 O\n0.500000 0.500000 0.000000 O\n0.725923 0.274077 0.500000 O\n0.274077 0.725923 0.500000 O\n",
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"elements": [
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"chemical_system": "Fe-O-Sr",
"density": 5.158662398806086,
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"volume": 241.37281501712823,
"volume_molar": 7.650426671950464,
"formula_full": "Sr4 Fe4 O11",
"formula_reduced": "Sr4Fe4O11",
"formula_anonymous": "A4B4C11",
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"total_magnetization": 18.0,
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"updated_at": "2021-11-28T01:35:40.884000Z",
"spacegroup": 65
}
]
}