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"id": "mp-2420",
"created_at": "2022-09-04T14:40:43.664187Z",
"structure_string": "P4 W4\n1.0\n3.266293 0.000000 0.000000\n0.000000 5.757727 0.000000\n0.000000 0.000000 6.269230\nP W\n4 4\ndirect\n0.750000 0.816475 0.565522 P\n0.250000 0.183525 0.434478 P\n0.750000 0.316475 0.934478 P\n0.250000 0.683525 0.065522 P\n0.750000 0.486250 0.311777 W\n0.750000 0.986250 0.188223 W\n0.250000 0.013750 0.811777 W\n0.250000 0.513750 0.688223 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"P",
"W"
],
"chemical_system": "P-W",
"density": 12.10182245775949,
"density_atomic": 0.06785308132943753,
"volume": 117.90179374697406,
"volume_molar": 8.87526497250957,
"formula_full": "P4 W4",
"formula_reduced": "PW",
"formula_anonymous": "AB",
"energy": -76.43774077,
"energy_per_atom": -9.55471759625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -76.43774077,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0053574,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:07.494000Z",
"spacegroup": 62
}
]
}