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"structure_string": "Li2 Mg4\n1.0\n-3.430257 -0.005489 0.003056\n1.706957 5.442680 -0.003652\n-0.002450 -2.321711 -6.712345\nLi Mg\n2 4\ndirect\n0.298864 0.597702 0.620135 Li\n0.645621 0.291201 0.768756 Li\n0.980016 0.960034 0.925270 Mg\n0.304639 0.609329 0.097118 Mg\n0.639763 0.279543 0.291752 Mg\n0.964427 0.928857 0.463633 Mg\n",
"nsites": 6,
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"elements": [
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],
"chemical_system": "Li-Mg",
"density": 1.4727066951370342,
"density_atomic": 0.047895701352133245,
"volume": 125.27220252789479,
"volume_molar": 12.573447282303503,
"formula_full": "Li2 Mg4",
"formula_reduced": "LiMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2692704761904762,
"spacegroup": 12
},
{
"id": "jvasp-121332",
"created_at": "2022-09-04T14:38:50.179562Z",
"updated_at": "2022-09-04T14:38:50.179580Z",
"structure_string": "N16 F8\n1.0\n4.120425 0.000000 0.000000\n0.000000 8.013652 0.000000\n-0.000000 0.000000 12.832996\nN F\n16 8\ndirect\n-0.062935 0.374211 0.444627 N\n0.430186 0.247500 0.276464 N\n0.069815 0.752500 0.776464 N\n0.569815 0.747500 0.223536 N\n-0.069815 0.252500 0.723536 N\n0.980941 0.510595 0.448455 N\n0.480940 0.989404 0.551545 N\n0.019061 0.010596 0.051545 N\n0.519061 0.489404 0.948456 N\n0.538193 0.151709 0.224531 N\n0.038193 0.348291 0.775469 N\n0.461808 0.651709 0.275469 N\n0.437066 0.125789 0.555373 N\n0.062935 0.874211 0.055373 N\n0.562935 0.625789 0.944627 N\n0.961808 0.848291 0.724532 N\n0.015725 0.494256 0.124973 F\n0.009037 0.324909 0.086264 F\n0.490964 0.675090 0.586264 F\n0.990965 0.824909 0.413736 F\n0.509037 0.175091 0.913736 F\n-0.015725 -0.005744 0.375027 F\n0.515725 0.005744 0.875027 F\n0.484276 0.505744 0.624973 F\n",
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{
"id": "jvasp-117769",
"created_at": "2022-09-04T14:38:53.684281Z",
"updated_at": "2022-09-04T14:38:53.684309Z",
"structure_string": "Rb1 Cd1 Br1\n1.0\n5.757319 0.000000 0.000000\n0.000000 5.757319 0.000000\n0.000000 -0.000000 9.441790\nRb Cd Br\n1 1 1\ndirect\n0.000000 0.000000 -0.030845 Rb\n0.000000 0.000000 0.593778 Cd\n0.000000 0.000000 0.296403 Br\n",
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"density": 1.47387117420582,
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"formula_full": "Rb1 Cd1 Br1",
"formula_reduced": "RbCdBr",
"formula_anonymous": "ABC",
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}
]
}