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{
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{
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"structure_string": "Ce4 Os8\n1.0\n2.678479 -4.639262 0.000000\n2.678479 4.639262 0.000000\n0.000000 0.000000 8.947549\nCe Os\n4 8\ndirect\n0.333333 0.666667 0.429247 Ce\n0.666667 0.333333 0.570753 Ce\n0.666667 0.333333 0.929247 Ce\n0.333333 0.666667 0.070753 Ce\n0.000000 0.000000 0.500000 Os\n0.000000 0.000000 0.000000 Os\n0.829459 0.170541 0.250000 Os\n0.829459 0.658918 0.250000 Os\n0.341082 0.170541 0.250000 Os\n0.170541 0.829459 0.750000 Os\n0.170541 0.341082 0.750000 Os\n0.658918 0.829459 0.750000 Os\n",
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{
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{
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{
"id": "mp-949",
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"structure_string": "Co1 Pt1\n1.0\n2.698393 0.000000 0.000000\n0.000000 2.698393 0.000000\n0.000000 0.000000 3.726631\nCo Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Pt\n",
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{
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"structure_string": "Dy14 Au51\n1.0\n6.403694 -11.091524 0.000000\n6.403694 11.091524 0.000000\n0.000000 0.000000 9.264979\nDy Au\n14 51\ndirect\n0.805154 0.008957 0.500000 Dy\n0.991043 0.796197 0.500000 Dy\n0.203803 0.194846 0.500000 Dy\n0.526904 0.657486 0.500000 Dy\n0.342514 0.869418 0.500000 Dy\n0.130582 0.473096 0.500000 Dy\n0.052490 0.604812 0.000000 Dy\n0.395188 0.447678 0.000000 Dy\n0.552322 0.947510 0.000000 Dy\n0.265441 0.049328 0.000000 Dy\n0.950672 0.216113 0.000000 Dy\n0.783887 0.734559 0.000000 Dy\n0.666667 0.333333 0.300019 Dy\n0.666667 0.333333 0.699981 Dy\n0.782357 0.955652 0.152128 Au\n0.044348 0.826705 0.152128 Au\n0.173295 0.217643 0.152128 Au\n0.550071 0.713708 0.150760 Au\n0.286292 0.836362 0.150760 Au\n0.163638 0.449929 0.150760 Au\n0.550071 0.713708 0.849240 Au\n0.286292 0.836362 0.849240 Au\n0.163638 0.449929 0.849240 Au\n0.782357 0.955652 0.847872 Au\n0.044348 0.826705 0.847872 Au\n0.173295 0.217643 0.847872 Au\n0.000000 0.000000 0.000000 Au\n0.333333 0.666667 0.000000 Au\n0.109224 0.671529 0.337706 Au\n0.328471 0.437695 0.337706 Au\n0.562305 0.890776 0.337706 Au\n0.222658 0.994258 0.338104 Au\n0.005742 0.228400 0.338104 Au\n0.771600 0.777342 0.338104 Au\n0.222658 0.994258 0.661896 Au\n0.005742 0.228400 0.661896 Au\n0.771600 0.777342 0.661896 Au\n0.109224 0.671529 0.662294 Au\n0.328471 0.437695 0.662294 Au\n0.562305 0.890776 0.662294 Au\n0.938258 0.412103 0.234585 Au\n0.587897 0.526155 0.234585 Au\n0.473845 0.061742 0.234585 Au\n0.402260 0.261094 0.226309 Au\n0.738906 0.141167 0.226309 Au\n0.858833 0.597740 0.226309 Au\n0.402260 0.261094 0.773691 Au\n0.738906 0.141167 0.773691 Au\n0.858833 0.597740 0.773691 Au\n0.938258 0.412103 0.765415 Au\n0.587897 0.526155 0.765415 Au\n0.473845 0.061742 0.765415 Au\n0.000000 0.000000 0.316735 Au\n0.333333 0.666667 0.317416 Au\n0.333333 0.666667 0.682584 Au\n0.000000 0.000000 0.683265 Au\n0.903393 0.509314 0.500000 Au\n0.490686 0.394079 0.500000 Au\n0.605921 0.096607 0.500000 Au\n0.427439 0.156550 0.500000 Au\n0.843450 0.270889 0.500000 Au\n0.729111 0.572561 0.500000 Au\n0.780059 0.307992 0.000000 Au\n0.692008 0.472068 0.000000 Au\n0.527932 0.219941 0.000000 Au\n",
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{
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{
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{
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"chemical_system": "Ce-Pt-Sb",
"density": 15.532613929486555,
"density_atomic": 0.05292000559324609,
"volume": 264.5502365892937,
"volume_molar": 11.379705448800209,
"formula_full": "Ce2 Sb2 Pt10",
"formula_reduced": "CeSbPt5",
"formula_anonymous": "ABC5",
"energy": -90.70970363,
"energy_per_atom": -6.479264545,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -90.70970363,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0272188,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:12.295000Z",
"spacegroup": 148
}
]
}