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{
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{
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"created_at": "2022-09-04T14:42:13.131293Z",
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{
"id": "mp-1205785",
"created_at": "2022-09-04T14:40:35.481010Z",
"structure_string": "Lu2 Mn4 Si2 C2\n1.0\n3.636529 0.000000 0.000000\n-1.818265 5.278577 0.000000\n0.000000 0.000000 6.957671\nLu Mn Si C\n2 4 2 2\ndirect\n0.457096 0.914191 0.250000 Lu\n0.542904 0.085809 0.750000 Lu\n0.167821 0.335641 0.060550 Mn\n0.832179 0.664359 0.939450 Mn\n0.832179 0.664359 0.560550 Mn\n0.167821 0.335641 0.439450 Mn\n0.736344 0.472688 0.250000 Si\n0.263656 0.527312 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
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{
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{
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"structure_string": "Ho4 Mn1 Ge8\n1.0\n0.000000 0.000000 4.000958\n4.188095 0.000000 0.000000\n0.000000 15.893984 0.000000\nHo Mn Ge\n4 1 8\ndirect\n0.250000 0.000000 0.100521 Ho\n0.250000 0.500000 0.607105 Ho\n0.750000 0.500000 0.398926 Ho\n0.750000 0.000000 0.896530 Ho\n0.250000 0.000000 0.310781 Mn\n0.250000 0.000000 0.460020 Ge\n0.250000 0.500000 0.945720 Ge\n0.750000 0.500000 0.053960 Ge\n0.750000 0.000000 0.566013 Ge\n0.250000 0.500000 0.240449 Ge\n0.250000 0.000000 0.749067 Ge\n0.750000 0.000000 0.235351 Ge\n0.750000 0.500000 0.753557 Ge\n",
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"chemical_system": "Ba-O-Sr-Tm",
"density": 8.079149472409616,
"density_atomic": 0.06730027646503914,
"volume": 312.03437939677696,
"volume_molar": 8.948166450888737,
"formula_full": "Ba1 Sr2 Tm6 O12",
"formula_reduced": "BaSr2Tm6O12",
"formula_anonymous": "AB2C6D12",
"energy": -170.67893485,
"energy_per_atom": -8.127568326190476,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -162.43493485,
"band_gap": 2.6055,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0019096,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:44.222000Z",
"spacegroup": 174
}
]
}