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{
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{
"id": "jvasp-37484",
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"updated_at": "2022-09-04T14:38:06.794463Z",
"structure_string": "Yb3 Mg1\n1.0\n5.119612 -0.000000 -0.000000\n0.000000 5.119612 -0.000000\n0.000000 0.000000 5.119612\nYb Mg\n3 1\ndirect\n0.500000 0.500000 0.000000 Yb\n0.500000 0.000000 0.500000 Yb\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Mg\n",
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{
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"updated_at": "2022-09-04T14:38:06.783322Z",
"structure_string": "Yb5 Mg1\n1.0\n9.548088 0.035148 0.000000\n-8.820494 3.655968 0.000000\n-0.000000 -0.000000 5.966599\nYb Mg\n5 1\ndirect\n0.997398 0.002603 -0.000000 Yb\n0.326837 0.673164 -0.000000 Yb\n0.665832 0.334170 -0.000000 Yb\n0.439789 0.560213 0.500000 Yb\n0.121704 0.878297 0.500000 Yb\n0.781777 0.218225 0.500000 Mg\n",
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"spacegroup": 38
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{
"id": "jvasp-106617",
"created_at": "2022-09-04T14:36:52.823720Z",
"updated_at": "2022-09-04T14:36:52.823754Z",
"structure_string": "Yb1 Mg3\n1.0\n4.518713 -0.000000 2.608880\n1.506238 4.260284 2.608880\n-0.000000 -0.000000 5.217761\nYb Mg\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 Mg\n0.750000 0.749999 0.750000 Mg\n",
"nsites": 4,
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"elements": [
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"density": 4.0659989409844774,
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"spacegroup": 225
},
{
"id": "jvasp-106399",
"created_at": "2022-09-04T14:36:52.248301Z",
"updated_at": "2022-09-04T14:36:52.248325Z",
"structure_string": "Yb2 Mg4\n1.0\n5.312001 -0.000000 3.066885\n1.770667 5.008203 3.066885\n-0.000000 -0.000000 6.133771\nYb Mg\n2 4\ndirect\n0.250000 0.250000 0.250000 Yb\n0.000000 0.000000 0.000000 Yb\n0.625000 0.125000 0.625001 Mg\n0.625000 0.625000 0.625001 Mg\n0.125000 0.625000 0.625000 Mg\n0.625000 0.625000 0.125001 Mg\n",
"nsites": 6,
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"elements": [
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],
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"density": 4.511066182489071,
"density_atomic": 0.03676915254411882,
"volume": 163.1802634776714,
"volume_molar": 16.378241931940405,
"formula_full": "Yb2 Mg4",
"formula_reduced": "YbMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0787723809523809,
"spacegroup": 227
},
{
"id": "jvasp-102135",
"created_at": "2022-09-04T14:36:43.109056Z",
"updated_at": "2022-09-04T14:36:43.109071Z",
"structure_string": "Yb4 Mg2\n1.0\n9.281897 0.040467 -0.000000\n-8.557245 3.595665 0.000000\n-0.000000 -0.000000 5.786737\nYb Mg\n4 2\ndirect\n0.593299 0.406703 0.750000 Yb\n0.280356 0.719646 0.750000 Yb\n0.406703 0.593299 0.250000 Yb\n0.719646 0.280356 0.250000 Yb\n0.937844 0.062158 0.750000 Mg\n0.062158 0.937844 0.250000 Mg\n",
"nsites": 6,
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"elements": [
"Yb",
"Mg"
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"density": 6.303762784415519,
"density_atomic": 0.030748124372087453,
"volume": 195.13385360983784,
"volume_molar": 19.585392224661298,
"formula_full": "Yb4 Mg2",
"formula_reduced": "Yb2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1508919047619047,
"spacegroup": 63
},
{
"id": "jvasp-20392",
"created_at": "2022-09-04T14:37:47.174144Z",
"updated_at": "2022-09-04T14:37:47.174163Z",
"structure_string": "Yb4 Mg8\n1.0\n3.087312 -5.347383 0.000000\n3.087312 5.347383 -0.000000\n-0.000000 -0.000000 9.997388\nYb Mg\n4 8\ndirect\n0.666667 0.333333 0.061024 Yb\n0.333333 0.666667 0.561024 Yb\n0.333333 0.666667 0.938976 Yb\n0.666667 0.333333 0.438976 Yb\n0.168750 0.337500 0.250000 Mg\n0.337500 0.168750 0.750000 Mg\n0.831249 0.168750 0.750000 Mg\n0.168750 0.831249 0.250000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.831249 0.662499 0.750000 Mg\n0.662499 0.831249 0.250000 Mg\n",
"nsites": 12,
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"density": 4.460037079021514,
"density_atomic": 0.036353220519695945,
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"formula_full": "Yb4 Mg8",
"formula_reduced": "YbMg2",
"formula_anonymous": "AB2",
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"spacegroup": 194
},
{
"id": "jvasp-39638",
"created_at": "2022-09-04T14:37:59.986093Z",
"updated_at": "2022-09-04T14:37:59.986115Z",
"structure_string": "Yb2 Mg6\n1.0\n3.392878 -5.876638 -0.000000\n3.392878 5.876638 0.000000\n-0.000000 -0.000000 5.303154\nYb Mg\n2 6\ndirect\n0.333333 0.666667 0.749999 Yb\n0.666667 0.333333 0.250000 Yb\n0.839101 0.678203 0.749999 Mg\n0.321798 0.160899 0.749999 Mg\n0.839101 0.160899 0.749999 Mg\n0.160899 0.839101 0.250000 Mg\n0.678203 0.839101 0.250000 Mg\n0.160899 0.321798 0.250000 Mg\n",
"nsites": 8,
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"elements": [
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"Mg"
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"density": 3.862543037600594,
"density_atomic": 0.03782932304206408,
"volume": 211.4761607313049,
"volume_molar": 15.919240091353783,
"formula_full": "Yb2 Mg6",
"formula_reduced": "YbMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0083999999999999,
"spacegroup": 194
},
{
"id": "jvasp-37511",
"created_at": "2022-09-04T14:38:01.821092Z",
"updated_at": "2022-09-04T14:38:01.821124Z",
"structure_string": "Yb3 Mg1\n1.0\n-0.000000 4.032549 4.032549\n4.032549 0.000000 4.032549\n4.032549 4.032549 0.000000\nYb Mg\n3 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Yb\n0.500000 0.500000 0.500000 Yb\n0.750000 0.750000 0.750000 Mg\n",
"nsites": 4,
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"density": 6.880496148301689,
"density_atomic": 0.03049938174948136,
"volume": 131.15019946487996,
"volume_molar": 19.74512404698959,
"formula_full": "Yb3 Mg1",
"formula_reduced": "Yb3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0779292857142857,
"spacegroup": 225
},
{
"id": "jvasp-109319",
"created_at": "2022-09-04T14:38:19.273454Z",
"updated_at": "2022-09-04T14:38:19.273480Z",
"structure_string": "Yb4 Mg2\n1.0\n6.183083 -0.014830 0.000000\n-3.138630 5.327263 0.000000\n-0.000000 -0.000000 5.797914\nYb Mg\n4 2\ndirect\n0.657205 0.977817 0.250000 Yb\n0.022182 0.342794 0.750000 Yb\n0.977817 0.657205 0.250000 Yb\n0.342794 0.022182 0.750000 Yb\n0.669362 0.669362 0.750000 Mg\n0.330637 0.330637 0.250000 Mg\n",
"nsites": 6,
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"elements": [
"Yb",
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],
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"density": 6.450087915550639,
"density_atomic": 0.031461860514257624,
"volume": 190.70709430171715,
"volume_molar": 19.14108276359224,
"formula_full": "Yb4 Mg2",
"formula_reduced": "Yb2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1445685714285714,
"spacegroup": 63
},
{
"id": "jvasp-108679",
"created_at": "2022-09-04T14:38:19.873138Z",
"updated_at": "2022-09-04T14:38:19.873160Z",
"structure_string": "Yb5 Mg1\n1.0\n6.826016 -0.018221 1.821543\n5.789752 3.615744 1.821543\n0.046320 0.013209 8.548661\nYb Mg\n5 1\ndirect\n0.002732 0.002732 0.021909 Yb\n0.279839 0.279839 0.945484 Yb\n0.661066 0.661065 0.671753 Yb\n0.953220 0.953218 0.585758 Yb\n0.320263 0.320262 0.338210 Yb\n0.616213 0.616212 0.270215 Mg\n",
"nsites": 6,
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"density": 6.981715181013782,
"density_atomic": 0.028360630854794764,
"volume": 211.56087925969445,
"volume_molar": 21.23415657018741,
"formula_full": "Yb5 Mg1",
"formula_reduced": "Yb5Mg",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0008333333333333,
"spacegroup": 8
},
{
"id": "jvasp-78756",
"created_at": "2022-09-04T14:36:34.250711Z",
"updated_at": "2022-09-04T14:36:34.250732Z",
"structure_string": "Yb1 Mg1\n1.0\n3.893471 0.000000 0.000000\n0.000000 2.757636 2.757621\n0.000000 -2.757636 2.757621\nYb Mg\n1 1\ndirect\n0.500000 0.416667 0.583333 Yb\n0.000000 0.916666 0.083331 Mg\n",
"nsites": 2,
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"elements": [
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"density": 5.533969577264002,
"density_atomic": 0.03377470294900645,
"volume": 59.215916806718624,
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"formula_full": "Yb1 Mg1",
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"formula_anonymous": "AB",
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"spacegroup": 221
},
{
"id": "jvasp-117170",
"created_at": "2022-09-04T14:38:48.797715Z",
"updated_at": "2022-09-04T14:38:48.797724Z",
"structure_string": "Yb1 Mn28\n1.0\n7.038345 -0.000000 -2.488431\n-3.519172 6.095385 -2.488431\n-0.000000 -0.000000 7.465292\nYb Mn\n1 28\ndirect\n0.000000 0.000000 0.000000 Yb\n0.623662 0.623663 0.822000 Mn\n0.198337 0.000000 0.376337 Mn\n0.000000 0.198338 0.376338 Mn\n0.801663 0.801663 0.178000 Mn\n0.801662 0.178000 0.801662 Mn\n0.000000 0.376338 0.198338 Mn\n0.198338 0.376338 0.000000 Mn\n0.376337 0.000000 0.198337 Mn\n0.178000 0.801663 0.801663 Mn\n0.376337 0.198338 0.000000 Mn\n0.606493 0.286959 0.606493 Mn\n0.286959 0.606494 0.606494 Mn\n0.822000 0.623663 0.623663 Mn\n0.606493 0.606494 0.286959 Mn\n0.000000 0.680466 0.393507 Mn\n0.319535 0.319535 0.713041 Mn\n0.319535 0.713042 0.319535 Mn\n0.000000 0.393507 0.680465 Mn\n0.680465 0.393507 0.000000 Mn\n0.393506 0.000000 0.680465 Mn\n0.713041 0.319535 0.319535 Mn\n0.393507 0.680466 0.000000 Mn\n0.376585 0.376586 0.376585 Mn\n0.000000 0.000000 0.623414 Mn\n0.000000 0.623415 0.000000 Mn\n0.623414 0.000000 -0.000000 Mn\n0.680465 0.000000 0.393506 Mn\n0.623663 0.822001 0.623663 Mn\n",
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"density": 8.872746840113457,
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"formula_full": "Yb1 Mn28",
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]
}