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{
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{
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{
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"structure_string": "Ce2 Te1 O2\n1.0\n-2.020550 2.020550 6.424984\n2.020550 -2.020550 6.424984\n2.020550 2.020550 -6.424984\nCe Te O\n2 1 2\ndirect\n0.656055 0.656055 0.000000 Ce\n0.343945 0.343945 0.000000 Ce\n0.000000 0.000000 0.000000 Te\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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{
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"structure_string": "Cd4 Sb4 O14\n1.0\n-3.670546 3.751649 5.183246\n3.670546 -3.751649 5.183246\n3.670546 3.751649 -5.183246\nCd Sb O\n4 4 14\ndirect\n0.000000 0.000000 0.500000 Cd\n0.000000 0.500000 0.000000 Cd\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Cd\n0.500000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n0.500000 0.000000 0.500000 Sb\n0.000000 0.500000 0.500000 Sb\n0.445175 0.090118 0.770513 O\n0.554825 0.325338 0.644942 O\n0.180396 0.409882 0.355058 O\n0.819604 0.174662 0.229487 O\n0.554825 0.909882 0.229487 O\n0.445175 0.674662 0.355058 O\n0.819604 0.590118 0.644942 O\n0.180396 0.825338 0.770513 O\n0.597658 0.750000 0.847658 O\n0.402342 0.250000 0.152342 O\n0.166761 0.902931 0.263830 O\n0.833239 0.097069 0.736170 O\n0.860899 0.597069 0.263830 O\n0.139101 0.402931 0.736170 O\n",
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"formation_energy_per_atom": null,
"energy_uncorrected": -28.163723600000004,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0085776,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.941000Z",
"spacegroup": 187
}
]
}