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{
"id": "mp-541787",
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"structure_string": "Na32 Hg12\n1.0\n17.749236 -4.646475 0.000000\n17.749236 4.646475 0.000000\n16.532861 0.000000 7.955478\nNa Hg\n32 12\ndirect\n0.209672 0.858439 0.486374 Na\n0.858439 0.486374 0.209672 Na\n0.486374 0.209672 0.858439 Na\n0.641561 0.290328 0.013626 Na\n0.290328 0.013626 0.641561 Na\n0.013626 0.641561 0.290328 Na\n0.790328 0.141561 0.513626 Na\n0.141561 0.513626 0.790328 Na\n0.513626 0.790328 0.141561 Na\n0.358439 0.709672 0.986374 Na\n0.709672 0.986374 0.358439 Na\n0.986374 0.358439 0.709672 Na\n0.633916 0.879401 0.143268 Na\n0.879401 0.143268 0.633916 Na\n0.143268 0.633916 0.879401 Na\n0.620599 0.866084 0.356732 Na\n0.866084 0.356732 0.620599 Na\n0.356732 0.620599 0.866084 Na\n0.366084 0.120599 0.856732 Na\n0.120599 0.856732 0.366084 Na\n0.856732 0.366084 0.120599 Na\n0.379401 0.133916 0.643268 Na\n0.133916 0.643268 0.379401 Na\n0.643268 0.379401 0.133916 Na\n0.561401 0.561401 0.561401 Na\n0.938599 0.938599 0.938599 Na\n0.438599 0.438599 0.438599 Na\n0.061401 0.061401 0.061401 Na\n0.219731 0.219731 0.219731 Na\n0.280269 0.280269 0.280269 Na\n0.780269 0.780269 0.780269 Na\n0.719731 0.719731 0.719731 Na\n0.065432 0.434568 0.750000 Hg\n0.434568 0.750000 0.065432 Hg\n0.750000 0.065432 0.434568 Hg\n0.934568 0.565432 0.250000 Hg\n0.565432 0.250000 0.934568 Hg\n0.250000 0.934568 0.565432 Hg\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Hg\n0.841940 0.841940 0.841940 Hg\n0.658060 0.658060 0.658060 Hg\n0.158060 0.158060 0.158060 Hg\n0.341940 0.341940 0.341940 Hg\n",
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{
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{
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{
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"formation_energy_per_atom": null,
"energy_uncorrected": -274.28850868,
"band_gap": 0.8791,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.0002237,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:35.358000Z",
"spacegroup": 8
}
]
}