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{
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{
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"structure_string": "Zr4 Ga2 P6 O24\n1.0\n8.452481 -4.438404 0.000000\n8.452481 4.438404 0.000000\n6.121872 0.000000 7.325746\nZr Ga P O\n4 2 6 24\ndirect\n0.350689 0.350689 0.350689 Zr\n0.850689 0.850689 0.850689 Zr\n0.649311 0.649311 0.649311 Zr\n0.149311 0.149311 0.149311 Zr\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n0.962504 0.537496 0.250000 P\n0.250000 0.962504 0.537496 P\n0.537496 0.250000 0.962504 P\n0.750000 0.037496 0.462504 P\n0.462504 0.750000 0.037496 P\n0.037496 0.462504 0.750000 P\n0.131808 0.510938 0.260953 O\n0.260953 0.131808 0.510938 O\n0.510938 0.260953 0.131808 O\n0.760953 0.010938 0.631808 O\n0.631808 0.760953 0.010938 O\n0.010938 0.631808 0.760953 O\n0.868192 0.489062 0.739047 O\n0.739047 0.868192 0.489062 O\n0.489062 0.739047 0.868192 O\n0.239047 0.989062 0.368192 O\n0.368192 0.239047 0.989062 O\n0.989062 0.368192 0.239047 O\n0.206200 0.430223 0.578042 O\n0.578042 0.206200 0.430223 O\n0.430223 0.578042 0.206200 O\n0.078042 0.930223 0.706200 O\n0.706200 0.078042 0.930223 O\n0.930223 0.706200 0.078042 O\n0.793800 0.569777 0.421958 O\n0.421958 0.793800 0.569777 O\n0.569777 0.421958 0.793800 O\n0.921958 0.069777 0.293800 O\n0.293800 0.921958 0.069777 O\n0.069777 0.293800 0.921958 O\n",
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"elements": [
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},
{
"id": "mp-1245440",
"created_at": "2022-09-04T14:43:45.512906Z",
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"chemical_system": "Ga-N-Zr",
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"formula_full": "Zr8 Ga4 N12",
"formula_reduced": "Zr2GaN3",
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"spacegroup": 15
},
{
"id": "mp-1102059",
"created_at": "2022-09-04T14:40:16.607962Z",
"structure_string": "Zr4 Ga2 Fe6\n1.0\n5.032094 0.000000 0.000000\n-2.516047 4.357921 0.000000\n0.000000 0.000000 8.210939\nZr Ga Fe\n4 2 6\ndirect\n0.333333 0.666667 0.434464 Zr\n0.666667 0.333333 0.565536 Zr\n0.666667 0.333333 0.934464 Zr\n0.333333 0.666667 0.065536 Zr\n0.000000 0.000000 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n0.827688 0.172312 0.250000 Fe\n0.827688 0.655376 0.250000 Fe\n0.344624 0.172312 0.250000 Fe\n0.172312 0.827688 0.750000 Fe\n0.172312 0.344624 0.750000 Fe\n0.655376 0.827688 0.750000 Fe\n",
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"volume": 180.061525007634,
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"formula_full": "Zr4 Ga2 Fe6",
"formula_reduced": "Zr2GaFe3",
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"energy": -95.67832902,
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"updated_at": "2021-11-28T01:34:55.375000Z",
"spacegroup": 194
},
{
"id": "mp-1095777",
"created_at": "2022-09-04T14:47:08.251000Z",
"structure_string": "Zr2 Ga1 Cu1\n1.0\n-5.360352 5.501070 7.760255\n5.360352 -5.501070 7.760255\n5.360352 5.501070 -7.760255\nZr Ga Cu\n2 1 1\ndirect\n0.000000 0.242983 0.242983 Zr\n0.000000 0.757017 0.757017 Zr\n0.000000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Cu\n",
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"volume": 915.3274031639137,
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"updated_at": "2021-11-28T01:37:52.658000Z",
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}
]
}