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{
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{
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{
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{
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{
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"created_at": "2022-09-04T14:42:54.184807Z",
"structure_string": "Gd1 Ge4 Rh6\n1.0\n3.613232 -6.258301 0.000000\n3.613232 6.258301 0.000000\n0.000000 0.000000 3.863897\nGd Ge Rh\n1 4 6\ndirect\n0.000000 0.000000 0.000000 Gd\n0.333333 0.666667 0.000000 Ge\n0.802962 0.605924 0.500000 Ge\n0.394076 0.197038 0.500000 Ge\n0.802962 0.197038 0.500000 Ge\n0.533362 0.066724 0.000000 Rh\n0.933276 0.466638 0.000000 Rh\n0.533362 0.466638 0.000000 Rh\n0.199542 0.399083 0.500000 Rh\n0.600917 0.800458 0.500000 Rh\n0.199542 0.800458 0.500000 Rh\n",
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{
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{
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"id": "mp-1205201",
"created_at": "2022-09-04T14:39:12.655018Z",
"structure_string": "Dy42 Rh28\n1.0\n-5.615134 5.615134 12.623478\n5.615134 -5.615134 12.623478\n5.615134 5.615134 -12.623478\nDy Rh\n42 28\ndirect\n0.632145 0.504520 0.279260 Dy\n0.225259 0.352885 0.720740 Dy\n0.132145 0.852885 0.127626 Dy\n0.725259 0.004520 0.872374 Dy\n0.352885 0.632145 0.127626 Dy\n0.504520 0.225259 0.872374 Dy\n0.004520 0.132145 0.279260 Dy\n0.852885 0.725259 0.720740 Dy\n0.367855 0.495480 0.720740 Dy\n0.774741 0.647115 0.279260 Dy\n0.867855 0.147115 0.872374 Dy\n0.274741 0.995480 0.127626 Dy\n0.647115 0.367855 0.872374 Dy\n0.495480 0.774741 0.127626 Dy\n0.995480 0.867855 0.720740 Dy\n0.147115 0.274741 0.279260 Dy\n0.386493 0.516852 0.290154 Dy\n0.226698 0.096339 0.709846 Dy\n0.886493 0.596339 0.869641 Dy\n0.726698 0.016852 0.130359 Dy\n0.096339 0.386493 0.869641 Dy\n0.516852 0.226698 0.130359 Dy\n0.016852 0.886493 0.290154 Dy\n0.596339 0.726698 0.709846 Dy\n0.613507 0.483148 0.709846 Dy\n0.773302 0.903661 0.290154 Dy\n0.113507 0.403661 0.130359 Dy\n0.273302 0.983148 0.869641 Dy\n0.903661 0.613507 0.130359 Dy\n0.483148 0.773302 0.869641 Dy\n0.983148 0.113507 0.709846 Dy\n0.403661 0.273302 0.290154 Dy\n0.849601 0.349601 0.199201 Dy\n0.150399 0.650399 0.800799 Dy\n0.349601 0.150399 0.500000 Dy\n0.650399 0.849601 0.500000 Dy\n0.388105 0.888105 0.500000 Dy\n0.888105 0.388105 0.500000 Dy\n0.611895 0.111895 0.500000 Dy\n0.111895 0.611895 0.500000 Dy\n0.250000 0.750000 0.500000 Dy\n0.750000 0.250000 0.500000 Dy\n0.714888 0.214888 0.142063 Rh\n0.072825 0.572825 0.857937 Rh\n0.214888 0.072825 0.500000 Rh\n0.572825 0.714888 0.500000 Rh\n0.285112 0.785112 0.857937 Rh\n0.927175 0.427175 0.142063 Rh\n0.785112 0.927175 0.500000 Rh\n0.427175 0.285112 0.500000 Rh\n0.465915 0.965915 0.808453 Rh\n0.157463 0.657463 0.191547 Rh\n0.965915 0.157463 0.500000 Rh\n0.657463 0.465915 0.500000 Rh\n0.534085 0.034085 0.191547 Rh\n0.842537 0.342537 0.808453 Rh\n0.034085 0.842537 0.500000 Rh\n0.342537 0.534085 0.500000 Rh\n0.596705 0.096705 0.693411 Rh\n0.403295 0.903295 0.306589 Rh\n0.096705 0.403295 0.500000 Rh\n0.903295 0.596705 0.500000 Rh\n0.366215 0.366215 0.000000 Rh\n0.866215 0.866215 0.000000 Rh\n0.633785 0.633785 0.000000 Rh\n0.133785 0.133785 0.000000 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n0.250000 0.250000 0.000000 Rh\n0.750000 0.750000 0.000000 Rh\n",
"nsites": 70,
"nelements": 2,
"elements": [
"Dy",
"Rh"
],
"chemical_system": "Dy-Rh",
"density": 10.123855914270916,
"density_atomic": 0.043968208618330694,
"volume": 1592.059403821525,
"volume_molar": 13.696579754421295,
"formula_full": "Dy42 Rh28",
"formula_reduced": "Dy3Rh2",
"formula_anonymous": "A2B3",
"energy": -453.35012059,
"energy_per_atom": -6.476430294142857,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -453.35012059,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0315981,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.599000Z",
"spacegroup": 140
}
]
}