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"results": [
{
"id": "mp-1095982",
"created_at": "2022-09-04T14:45:43.240758Z",
"structure_string": "Ca2 Al1 Cd1\n1.0\n-6.283447 6.470863 9.137937\n6.283447 -6.470863 9.137937\n6.283447 6.470863 -9.137937\nCa Al Cd\n2 1 1\ndirect\n0.000000 0.233045 0.233045 Ca\n0.000000 0.766955 0.766955 Ca\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Cd\n",
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{
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"structure_string": "Yb1 Mg1\n1.0\n3.975026 0.000000 0.000000\n0.000000 3.975026 0.000000\n0.000000 0.000000 3.859557\nYb Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
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"elements": [
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"updated_at": "2021-11-28T01:36:36.268000Z",
"spacegroup": 123
},
{
"id": "mp-1857",
"created_at": "2022-09-04T14:46:07.313696Z",
"structure_string": "Yb1 Cd1\n1.0\n3.811121 0.000000 0.000000\n0.000000 3.811121 0.000000\n0.000000 0.000000 3.811121\nYb Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
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"elements": [
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],
"chemical_system": "Cd-Yb",
"density": 8.562931182998609,
"density_atomic": 0.03613031793199636,
"volume": 55.35517300911532,
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"formula_full": "Yb1 Cd1",
"formula_reduced": "YbCd",
"formula_anonymous": "AB",
"energy": -3.25456455,
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"total_magnetization": 0.0016591,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:25.201000Z",
"spacegroup": 221
},
{
"id": "mp-1095784",
"created_at": "2022-09-04T14:48:08.884858Z",
"structure_string": "Li1 Al1 Zn2\n1.0\n-5.311388 5.322754 7.526007\n5.311388 -5.322754 7.526007\n5.311388 5.322754 -7.526007\nLi Al Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Al\n0.000000 0.249880 0.249880 Zn\n0.000000 0.750120 0.750120 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Al",
"Zn"
],
"chemical_system": "Al-Li-Zn",
"density": 0.32142566175254844,
"density_atomic": 0.004699925339734008,
"volume": 851.0773492896335,
"volume_molar": 128.13268987674647,
"formula_full": "Li1 Al1 Zn2",
"formula_reduced": "LiAlZn2",
"formula_anonymous": "ABC2",
"energy": -3.25380539,
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"energy_uncorrected": -3.25380539,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:38:28.739000Z",
"spacegroup": 71
},
{
"id": "mp-1097594",
"created_at": "2022-09-04T14:46:27.740081Z",
"structure_string": "Ca2 Cd1 Ga1\n1.0\n-6.201449 6.461740 9.135863\n6.201449 -6.461740 9.135863\n6.201449 6.461740 -9.135863\nCa Cd Ga\n2 1 1\ndirect\n0.000000 0.231135 0.231135 Ca\n0.000000 0.768865 0.768865 Ca\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Cd",
"Ga"
],
"chemical_system": "Ca-Cd-Ga",
"density": 0.2974257771590792,
"density_atomic": 0.0027315412655051236,
"volume": 1464.374728843904,
"volume_molar": 220.46676856212054,
"formula_full": "Ca2 Cd1 Ga1",
"formula_reduced": "Ca2CdGa",
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"energy": -3.25160176,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:37:41.325000Z",
"spacegroup": 71
},
{
"id": "mp-1093539",
"created_at": "2022-09-04T14:39:39.871500Z",
"structure_string": "Ca2 Al1 Zn1\n1.0\n-6.090680 6.122124 8.590928\n6.090680 -6.122124 8.590928\n6.090680 6.122124 -8.590928\nCa Al Zn\n2 1 1\ndirect\n0.240109 0.000000 0.240109 Ca\n0.759891 0.000000 0.759891 Ca\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Zn\n",
"nsites": 4,
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"elements": [
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"Al",
"Zn"
],
"chemical_system": "Al-Ca-Zn",
"density": 0.22360801897211968,
"density_atomic": 0.0031217061245184807,
"volume": 1281.3505949785697,
"volume_molar": 192.91184114676742,
"formula_full": "Ca2 Al1 Zn1",
"formula_reduced": "Ca2AlZn",
"formula_anonymous": "ABC2",
"energy": -3.24241091,
"energy_per_atom": -0.8106027275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -3.24241091,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.402000Z",
"spacegroup": 71
},
{
"id": "mp-1093771",
"created_at": "2022-09-04T14:43:00.799667Z",
"structure_string": "Sr2 Zn1 Ag1\n1.0\n-6.536265 6.721546 9.241152\n6.536265 -6.721546 9.241152\n6.536265 6.721546 -9.241152\nSr Zn Ag\n2 1 1\ndirect\n0.263811 0.000000 0.263811 Sr\n0.736189 0.000000 0.736189 Sr\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Ag\n",
"nsites": 4,
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"elements": [
"Sr",
"Zn",
"Ag"
],
"chemical_system": "Ag-Sr-Zn",
"density": 0.3563595337811546,
"density_atomic": 0.0024630603876534254,
"volume": 1623.9959117733315,
"volume_molar": 244.4982993590886,
"formula_full": "Sr2 Zn1 Ag1",
"formula_reduced": "Sr2ZnAg",
"formula_anonymous": "ABC2",
"energy": -3.24057299,
"energy_per_atom": -0.8101432475,
"energy_above_hull": null,
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"energy_uncorrected": -3.24057299,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:07.242000Z",
"spacegroup": 71
},
{
"id": "mp-1093660",
"created_at": "2022-09-04T14:48:28.490433Z",
"structure_string": "Li1 Mg2 In1\n1.0\n-5.866142 5.920438 8.479989\n5.866142 -5.920438 8.479989\n5.866142 5.920438 -8.479989\nLi Mg In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.249155 0.249155 Mg\n0.000000 0.750845 0.750845 Mg\n0.000000 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Mg",
"In"
],
"chemical_system": "In-Li-Mg",
"density": 0.24014745164841006,
"density_atomic": 0.0033954575245069133,
"volume": 1178.0444818201277,
"volume_molar": 177.35874227655174,
"formula_full": "Li1 Mg2 In1",
"formula_reduced": "LiMg2In",
"formula_anonymous": "ABC2",
"energy": -3.23244003,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:39:21.962000Z",
"spacegroup": 71
},
{
"id": "mp-1093547",
"created_at": "2022-09-04T14:41:05.888961Z",
"structure_string": "Ba2 Ag1 Hg1\n1.0\n-6.749469 7.046744 9.541310\n6.749469 -7.046744 9.541310\n6.749469 7.046744 -9.541310\nBa Ag Hg\n2 1 1\ndirect\n0.764543 0.000000 0.764543 Ba\n0.235457 0.000000 0.235457 Ba\n0.000000 0.000000 0.000000 Ag\n0.500000 0.000000 0.500000 Hg\n",
"nsites": 4,
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"elements": [
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"Ag",
"Hg"
],
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"density": 0.5334271621972856,
"density_atomic": 0.002203605726012615,
"volume": 1815.2067553563352,
"volume_molar": 273.28576473146836,
"formula_full": "Ba2 Ag1 Hg1",
"formula_reduced": "Ba2AgHg",
"formula_anonymous": "ABC2",
"energy": -3.21890947,
"energy_per_atom": -0.8047273675,
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"updated_at": "2021-11-28T01:35:13.585000Z",
"spacegroup": 71
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{
"id": "mp-1096236",
"created_at": "2022-09-04T14:41:22.901171Z",
"structure_string": "Ba2 Ga1 Hg1\n1.0\n-6.824689 6.919959 9.552362\n6.824689 -6.919959 9.552362\n6.824689 6.919959 -9.552362\nBa Ga Hg\n2 1 1\ndirect\n0.231248 0.000000 0.231248 Ba\n0.768752 0.000000 0.768752 Ba\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.500000 Hg\n",
"nsites": 4,
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"elements": [
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],
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"density": 0.5014898550690652,
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"volume": 1804.5010968031927,
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"formula_full": "Ba2 Ga1 Hg1",
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"updated_at": "2021-11-28T01:35:11.568000Z",
"spacegroup": 71
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{
"id": "mp-1095767",
"created_at": "2022-09-04T14:46:58.738599Z",
"structure_string": "Mg2 Hg1 Pb1\n1.0\n-5.579237 6.044697 9.049839\n5.579237 -6.044697 9.049839\n5.579237 6.044697 -9.049839\nMg Hg Pb\n2 1 1\ndirect\n0.000000 0.249307 0.249307 Mg\n0.000000 0.750693 0.750693 Mg\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
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"volume": 1220.8159382846734,
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"formula_full": "Mg2 Hg1 Pb1",
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"band_gap": 0.3986999999999998,
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"updated_at": "2021-11-28T01:37:46.336000Z",
"spacegroup": 71
},
{
"id": "mp-1185885",
"created_at": "2022-09-04T14:45:31.361853Z",
"structure_string": "Mg1 Hg5\n1.0\n3.708060 0.000000 0.000000\n-1.854030 3.211274 0.000000\n0.000000 0.000000 13.158086\nMg Hg\n1 5\ndirect\n0.666668 0.333334 0.833334 Mg\n0.666668 0.333334 0.159667 Hg\n0.000000 0.000000 0.333333 Hg\n0.666668 0.333334 0.507000 Hg\n0.000000 0.000000 0.681853 Hg\n0.000000 0.000000 0.984813 Hg\n",
"nsites": 6,
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"elements": [
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"density": 10.887057704006876,
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"volume": 156.68118101664703,
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"formula_full": "Mg1 Hg5",
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"formula_anonymous": "AB5",
"energy": -3.21242381,
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"updated_at": "2021-11-28T01:37:04.734000Z",
"spacegroup": 187
}
]
}