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"structure_string": "Sm8 Sb20\n1.0\n4.257145 0.000000 0.000000\n-0.000000 13.125642 2.819352\n0.000000 0.056415 14.974666\nSm Sb\n8 20\ndirect\n0.250000 0.668725 0.577861 Sm\n0.750001 0.331275 0.422139 Sm\n0.250000 0.391557 0.771489 Sm\n0.750001 0.608443 0.228511 Sm\n0.250000 0.951918 0.362671 Sm\n0.750001 0.048081 0.637330 Sm\n0.250000 0.662275 0.855223 Sm\n0.750001 0.337724 0.144777 Sm\n0.750001 0.287049 0.650510 Sb\n0.250000 0.140278 0.778776 Sb\n0.750001 0.859722 0.221224 Sb\n0.750001 0.856469 0.519864 Sb\n0.750001 0.574595 0.734913 Sb\n0.250000 0.143531 0.480136 Sb\n0.250000 0.712951 0.349490 Sb\n0.250000 0.425405 0.265087 Sb\n0.750001 0.848886 0.825692 Sb\n0.750001 0.580800 0.024510 Sb\n0.750001 0.138665 0.322364 Sb\n0.250000 0.861334 0.677636 Sb\n0.250000 0.970640 0.099128 Sb\n0.250000 0.419200 0.975490 Sb\n0.750001 0.279373 0.940213 Sb\n0.250000 0.720627 0.059787 Sb\n0.750001 0.575234 0.448035 Sb\n0.250000 0.424766 0.551966 Sb\n0.250000 0.151113 0.174308 Sb\n0.750001 0.029359 0.900872 Sb\n",
"nsites": 28,
"nelements": 2,
"elements": [
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],
"chemical_system": "Sb-Sm",
"density": 7.22564768556524,
"density_atomic": 0.033489870724971074,
"volume": 836.0736961317185,
"volume_molar": 17.981976727995274,
"formula_full": "Sm8 Sb20",
"formula_reduced": "Sm2Sb5",
"formula_anonymous": "A2B5",
"energy_above_hull": 1.7102868928571426,
"spacegroup": 11
},
{
"id": "jvasp-57731",
"created_at": "2022-09-04T14:38:32.955815Z",
"updated_at": "2022-09-04T14:38:32.955831Z",
"structure_string": "Sm8 Sb6\n1.0\n7.645432 -0.000000 -2.703068\n-3.822716 6.621138 -2.703068\n0.000000 0.000000 8.109205\nSm Sb\n8 6\ndirect\n0.357251 0.500000 -0.000000 Sm\n0.642749 0.642749 0.642749 Sm\n0.500000 0.000000 0.357251 Sm\n-0.000000 0.357251 0.500000 Sm\n0.500000 0.000000 0.857251 Sm\n-0.000000 0.857251 0.500000 Sm\n0.857251 0.500000 -0.000000 Sm\n0.142749 0.142749 0.142749 Sm\n0.749999 0.875000 0.125000 Sb\n0.625000 0.375000 0.250000 Sb\n0.875000 0.125000 0.750000 Sb\n0.125000 0.750000 0.875000 Sb\n0.375000 0.250000 0.625000 Sb\n0.250000 0.625000 0.375000 Sb\n",
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"elements": [
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],
"chemical_system": "Sb-Sm",
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"formula_full": "Sm8 Sb6",
"formula_reduced": "Sm4Sb3",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.6319133999999995,
"spacegroup": 220
}
]
}