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"id": "mp-13495",
"created_at": "2022-09-04T14:47:13.957789Z",
"structure_string": "Zr2 Pd2\n1.0\n1.670534 -5.221097 0.000000\n1.670534 5.221097 0.000000\n0.000000 0.000000 4.441156\nZr Pd\n2 2\ndirect\n0.857752 0.142248 0.750000 Zr\n0.142248 0.857752 0.250000 Zr\n0.588457 0.411543 0.750000 Pd\n0.411543 0.588457 0.250000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Pd"
],
"chemical_system": "Pd-Zr",
"density": 8.472656953462202,
"density_atomic": 0.05163175487500231,
"volume": 77.47170340585525,
"volume_molar": 11.663637570675792,
"formula_full": "Zr2 Pd2",
"formula_reduced": "ZrPd",
"formula_anonymous": "AB",
"energy": -30.06300801,
"energy_per_atom": -7.5157520025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -30.06300801,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000363,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:58.918000Z",
"spacegroup": 63
}
]
}