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{
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"id": "mp-1198128",
"created_at": "2022-09-04T14:42:53.310843Z",
"structure_string": "Sm20 Sn16\n1.0\n-8.189220 0.000000 0.000000\n0.000000 0.000000 -8.364556\n0.000000 -15.883322 0.000000\nSm Sn\n20 16\ndirect\n0.367255 0.834276 0.879124 Sm\n0.867255 0.665724 0.620876 Sm\n0.632745 0.165724 0.379124 Sm\n0.132745 0.334276 0.120876 Sm\n0.632745 0.165724 0.120876 Sm\n0.132745 0.334276 0.379124 Sm\n0.367255 0.834276 0.620876 Sm\n0.867255 0.665724 0.879124 Sm\n0.520383 0.319464 0.900491 Sm\n0.020383 0.180536 0.599509 Sm\n0.479617 0.680536 0.400491 Sm\n0.979617 0.819464 0.099509 Sm\n0.479617 0.680536 0.099509 Sm\n0.979617 0.819464 0.400491 Sm\n0.520383 0.319464 0.599509 Sm\n0.020383 0.180536 0.900491 Sm\n0.197215 0.502046 0.750000 Sm\n0.697215 0.997954 0.750000 Sm\n0.802785 0.497954 0.250000 Sm\n0.302785 0.002046 0.250000 Sm\n0.293296 0.033350 0.041394 Sn\n0.793296 0.466650 0.458606 Sn\n0.706704 0.966650 0.541394 Sn\n0.206704 0.533350 0.958606 Sn\n0.706704 0.966650 0.958606 Sn\n0.206704 0.533350 0.541394 Sn\n0.293296 0.033350 0.458606 Sn\n0.793296 0.466650 0.041394 Sn\n0.566031 0.618916 0.750000 Sn\n0.066031 0.881084 0.750000 Sn\n0.433969 0.381084 0.250000 Sn\n0.933969 0.118916 0.250000 Sn\n0.325707 0.144309 0.750000 Sn\n0.825707 0.355691 0.750000 Sn\n0.674293 0.855691 0.250000 Sn\n0.174293 0.644309 0.250000 Sn\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Sm",
"Sn"
],
"chemical_system": "Sm-Sn",
"density": 7.488579412279018,
"density_atomic": 0.03308839708136884,
"volume": 1087.9946801735707,
"volume_molar": 18.200158639267844,
"formula_full": "Sm20 Sn16",
"formula_reduced": "Sm5Sn4",
"formula_anonymous": "A4B5",
"energy": -185.68453654,
"energy_per_atom": -5.157903792777778,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -185.68453654,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004042,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:58.945000Z",
"spacegroup": 62
}
]
}