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{
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{
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{
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"created_at": "2022-09-04T14:42:07.680954Z",
"structure_string": "Mg30 Al1 Zn1 O32\n1.0\n8.540403 0.000000 0.000000\n0.000000 8.540403 0.000000\n0.000000 0.000000 8.560845\nMg Al Zn O\n30 1 1 32\ndirect\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.249924 0.251063 Mg\n0.000000 0.249924 0.748937 Mg\n0.000000 0.750076 0.251063 Mg\n0.000000 0.750076 0.748937 Mg\n0.500000 0.250111 0.250718 Mg\n0.500000 0.250111 0.749282 Mg\n0.500000 0.749889 0.250718 Mg\n0.500000 0.749889 0.749282 Mg\n0.249924 0.000000 0.251063 Mg\n0.249924 0.000000 0.748937 Mg\n0.250111 0.500000 0.250718 Mg\n0.250111 0.500000 0.749282 Mg\n0.750076 0.000000 0.251063 Mg\n0.750076 0.000000 0.748937 Mg\n0.749889 0.500000 0.250718 Mg\n0.749889 0.500000 0.749282 Mg\n0.250394 0.250394 0.000000 Mg\n0.250112 0.250112 0.500000 Mg\n0.250394 0.749606 0.000000 Mg\n0.250112 0.749888 0.500000 Mg\n0.749606 0.250394 0.000000 Mg\n0.749888 0.250112 0.500000 Mg\n0.749606 0.749606 0.000000 Mg\n0.749888 0.749888 0.500000 Mg\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Zn\n0.238017 0.000000 0.000000 O\n0.257585 0.000000 0.500000 O\n0.248010 0.500000 0.000000 O\n0.250993 0.500000 0.500000 O\n0.761983 0.000000 0.000000 O\n0.742415 0.000000 0.500000 O\n0.751990 0.500000 0.000000 O\n0.749007 0.500000 0.500000 O\n0.249503 0.249503 0.249413 O\n0.249503 0.249503 0.750587 O\n0.249503 0.750497 0.249413 O\n0.249503 0.750497 0.750587 O\n0.750497 0.249503 0.249413 O\n0.750497 0.249503 0.750587 O\n0.750497 0.750497 0.249413 O\n0.750497 0.750497 0.750587 O\n0.000000 0.000000 0.222669 O\n0.000000 0.000000 0.777331 O\n0.000000 0.500000 0.245627 O\n0.000000 0.500000 0.754373 O\n0.500000 0.000000 0.245627 O\n0.500000 0.000000 0.754373 O\n0.500000 0.500000 0.248663 O\n0.500000 0.500000 0.751337 O\n0.000000 0.238017 0.000000 O\n0.000000 0.257585 0.500000 O\n0.000000 0.761983 0.000000 O\n0.000000 0.742415 0.500000 O\n0.500000 0.248010 0.000000 O\n0.500000 0.250993 0.500000 O\n0.500000 0.751990 0.000000 O\n0.500000 0.749007 0.500000 O\n",
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{
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{
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"band_gap": 1.9765,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.0001971,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:40.313000Z",
"spacegroup": 123
}
]
}