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],
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"density": 4.6512924579393715,
"density_atomic": 0.06628751850140142,
"volume": 211.20114791601404,
"volume_molar": 9.08487886731298,
"formula_full": "Fe6 S8",
"formula_reduced": "Fe3S4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.844883785714285,
"spacegroup": 227
},
{
"id": "jvasp-117434",
"created_at": "2022-09-04T14:38:26.559963Z",
"updated_at": "2022-09-04T14:38:26.559992Z",
"structure_string": "Co1 Sn3 P4 O16\n1.0\n4.984988 0.047410 -0.000236\n-0.022200 10.009237 -0.000167\n0.000526 0.000098 6.050121\nCo Sn P O\n1 3 4 16\ndirect\n0.105540 0.723050 0.750011 Co\n0.405871 0.217066 0.749982 Sn\n0.599363 0.783235 0.250001 Sn\n0.903348 0.288306 0.249942 Sn\n0.168031 0.599685 0.250023 P\n0.383589 0.072027 0.250000 P\n0.631402 0.911938 0.749999 P\n0.815142 0.417308 0.749980 P\n0.638984 0.355850 0.555808 O\n0.859624 0.625391 0.249996 O\n0.685471 0.079608 0.250016 O\n0.782298 0.843679 0.951910 O\n0.782291 0.843678 0.548080 O\n0.691119 0.065464 0.749997 O\n0.297094 0.923899 0.250009 O\n0.094770 0.349114 0.750049 O\n0.248918 0.144911 0.045561 O\n0.332275 0.888997 0.750015 O\n0.638878 0.355884 0.944130 O\n0.308390 0.673444 0.451192 O\n0.308414 0.673422 0.048833 O\n0.226061 0.452546 0.250069 O\n0.248879 0.144928 0.454421 O\n0.844261 0.566573 0.749963 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Co",
"Sn",
"P",
"O"
],
"chemical_system": "Co-O-P-Sn",
"density": 4.3727017537683395,
"density_atomic": 0.0795010617211666,
"volume": 301.88276081362284,
"volume_molar": 7.574918660987704,
"formula_full": "Co1 Sn3 P4 O16",
"formula_reduced": "CoSn3(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 2.84454725,
"spacegroup": 6
}
]
}