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"updated_at": "2022-09-04T14:38:27.264491Z",
"structure_string": "V1 Ga2 Fe1 Co4\n1.0\n3.876943 0.000424 5.826903\n1.761664 3.453582 5.826903\n0.000693 0.000424 6.998821\nV Ga Fe Co\n1 2 1 4\ndirect\n0.499999 0.499998 0.500001 V\n0.250221 0.250221 0.250222 Ga\n0.749778 0.749776 0.749780 Ga\n0.000000 0.000000 0.000000 Fe\n0.624735 0.624734 0.624737 Co\n0.125552 0.125552 0.125553 Co\n0.874447 0.874445 0.874450 Co\n0.375264 0.375263 0.375265 Co\n",
"nsites": 8,
"nelements": 4,
"elements": [
"V",
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"Fe",
"Co"
],
"chemical_system": "Co-Fe-Ga-V",
"density": 8.542674564833714,
"density_atomic": 0.0853923564188337,
"volume": 93.68520012214536,
"volume_molar": 7.0523182783041065,
"formula_full": "V1 Ga2 Fe1 Co4",
"formula_reduced": "VGa2FeCo4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.88832724375,
"spacegroup": 166
},
{
"id": "jvasp-30374",
"created_at": "2022-09-04T14:37:19.713120Z",
"updated_at": "2022-09-04T14:37:19.713140Z",
"structure_string": "V3 Fe3 Te2 O16\n1.0\n5.585256 -0.025618 -0.064148\n-2.814059 4.874157 0.004245\n-0.120425 -0.074350 10.605504\nV Fe Te O\n3 3 2 16\ndirect\n0.637655 0.819074 0.235294 V\n0.803197 0.640422 0.721777 V\n0.804783 0.163709 0.722753 V\n0.176218 0.820763 0.213331 Fe\n0.176263 0.355935 0.213344 Fe\n0.362695 0.181061 0.705766 Fe\n0.312372 0.656075 0.509749 Te\n0.665697 0.333142 0.018330 Te\n0.843056 0.679790 0.109890 O\n0.683320 0.341045 0.604813 O\n0.509736 0.009365 0.816059 O\n0.509362 0.499797 0.815794 O\n0.666941 0.833189 0.603962 O\n0.330624 0.165620 0.118071 O\n0.497312 0.514498 0.326003 O\n0.007269 0.003785 0.296441 O\n0.164155 0.322543 0.610345 O\n0.009330 0.004468 0.792021 O\n0.970045 0.484860 0.817643 O\n0.347525 0.674078 0.111060 O\n0.017897 0.509095 0.306810 O\n0.164131 0.840905 0.610594 O\n0.497324 0.983147 0.325961 O\n0.843110 0.163837 0.109895 O\n",
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"elements": [
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],
"chemical_system": "Fe-O-Te-V",
"density": 4.7961134384565645,
"density_atomic": 0.08336106897434105,
"volume": 287.9041775170532,
"volume_molar": 7.22416450999884,
"formula_full": "V3 Fe3 Te2 O16",
"formula_reduced": "V3Fe3(TeO8)2",
"formula_anonymous": "A2B3C3D16",
"energy_above_hull": 3.3192696097222223,
"spacegroup": 8
},
{
"id": "jvasp-12694",
"created_at": "2022-09-04T14:38:11.546768Z",
"updated_at": "2022-09-04T14:38:11.546784Z",
"structure_string": "V2 Fe2 H4 O10\n1.0\n5.254026 -0.009432 -0.002749\n-1.604918 5.364483 -0.039290\n-0.562001 -1.496149 6.213884\nV Fe H O\n2 2 4 10\ndirect\n0.256105 0.618542 0.757081 V\n0.743895 0.381458 0.242918 V\n0.627726 0.206121 0.692112 Fe\n0.372274 0.793878 0.307888 Fe\n0.078197 0.116071 0.701500 H\n0.921804 0.883929 0.298499 H\n0.850941 0.851077 0.705181 H\n0.149059 0.148923 0.294818 H\n0.907005 0.519565 0.730478 O\n0.092996 0.480435 0.269521 O\n0.903018 0.041124 0.749227 O\n0.365831 0.871869 0.613286 O\n0.642060 0.644410 0.347581 O\n0.398766 0.740198 0.018586 O\n0.601234 0.259802 0.981413 O\n0.096982 0.958876 0.250772 O\n0.357941 0.355590 0.652418 O\n0.634170 0.128131 0.386713 O\n",
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"nelements": 4,
"elements": [
"V",
"Fe",
"H",
"O"
],
"chemical_system": "Fe-H-O-V",
"density": 3.5886756701203035,
"density_atomic": 0.10302130775762211,
"volume": 174.72113674142577,
"volume_molar": 5.84552932891152,
"formula_full": "V2 Fe2 H4 O10",
"formula_reduced": "VFeH2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 3.1020085777777777,
"spacegroup": 2
}
]
}