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"results": [
{
"id": "mp-1095982",
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"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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"spacegroup": 221
},
{
"id": "mp-23903",
"created_at": "2022-09-04T14:39:46.021406Z",
"structure_string": "H1 Br1\n1.0\n0.000000 2.445822 2.445822\n2.445822 0.000000 2.445822\n2.445822 2.445822 0.000000\nH Br\n1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.500000 0.500000 0.500000 Br\n",
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"elements": [
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"formula_full": "H1 Br1",
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"updated_at": "2021-11-28T01:34:29.084000Z",
"spacegroup": 225
},
{
"id": "mp-30496",
"created_at": "2022-09-04T14:41:26.562600Z",
"structure_string": "Sr1 Cd1\n1.0\n4.081591 0.000000 0.000000\n0.000000 4.081591 0.000000\n0.000000 0.000000 4.081591\nSr Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
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"elements": [
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"density": 4.884925589578841,
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"volume": 67.99679625410673,
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"formula_full": "Sr1 Cd1",
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"updated_at": "2021-11-28T01:35:28.193000Z",
"spacegroup": 221
},
{
"id": "mp-1093696",
"created_at": "2022-09-04T14:43:24.159198Z",
"structure_string": "Ca2 Mg1 Al1\n1.0\n-6.396529 6.445862 9.091876\n6.396529 -6.445862 9.091876\n6.396529 6.445862 -9.091876\nCa Mg Al\n2 1 1\ndirect\n0.000000 0.270558 0.270558 Ca\n0.000000 0.729442 0.729442 Ca\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Al\n",
"nsites": 4,
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"elements": [
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"volume": 1499.4737657232777,
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"formula_full": "Ca2 Mg1 Al1",
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"spacegroup": 71
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{
"id": "mp-1184764",
"created_at": "2022-09-04T14:44:05.048252Z",
"structure_string": "K3\n1.0\n11.247526 -2.394394 0.000000\n11.247526 2.394394 0.000000\n10.737803 0.000000 4.115769\nK\n3\ndirect\n0.000000 0.000000 0.000000 K\n0.777748 0.777748 0.777748 K\n0.222252 0.222252 0.222252 K\n",
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"elements": [
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"volume": 221.68362206236526,
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"updated_at": "2021-11-28T01:36:29.208000Z",
"spacegroup": 166
},
{
"id": "mp-1097365",
"created_at": "2022-09-04T14:41:20.218240Z",
"structure_string": "Ba2 Zn1 Ag1\n1.0\n-6.564502 6.818154 9.432126\n6.564502 -6.818154 9.432126\n6.564502 6.818154 -9.432126\nBa Zn Ag\n2 1 1\ndirect\n0.742007 0.000000 0.742007 Ba\n0.257993 0.000000 0.257993 Ba\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Ag\n",
"nsites": 4,
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"elements": [
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"density": 0.440475984388458,
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"volume": 1688.6442918827793,
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"formula_full": "Ba2 Zn1 Ag1",
"formula_reduced": "Ba2ZnAg",
"formula_anonymous": "ABC2",
"energy": -3.26761951,
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"energy_above_hull": null,
"is_stable": null,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:16.983000Z",
"spacegroup": 71
},
{
"id": "mp-1096058",
"created_at": "2022-09-04T14:39:26.342511Z",
"structure_string": "Ba2 Zn1 Ga1\n1.0\n-6.584391 6.773162 9.287944\n6.584391 -6.773162 9.287944\n6.584391 6.773162 -9.287944\nBa Zn Ga\n2 1 1\ndirect\n0.263926 0.000000 0.263926 Ba\n0.736074 0.000000 0.736074 Ba\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Ga\n",
"nsites": 4,
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"Zn",
"Ga"
],
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"density": 0.41069513575582467,
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"volume": 1656.8632124007252,
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"formula_full": "Ba2 Zn1 Ga1",
"formula_reduced": "Ba2ZnGa",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:34:32.758000Z",
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{
"id": "mp-1096465",
"created_at": "2022-09-04T14:47:15.663126Z",
"structure_string": "Sr2 Cd1 Ag1\n1.0\n-6.700585 6.815479 9.457945\n6.700585 -6.815479 9.457945\n6.700585 6.815479 -9.457945\nSr Cd Ag\n2 1 1\ndirect\n0.766492 0.000000 0.766492 Sr\n0.233508 0.000000 0.233508 Sr\n0.500000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"volume": 1727.690241617296,
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"formula_full": "Sr2 Cd1 Ag1",
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"updated_at": "2021-11-28T01:38:03.253000Z",
"spacegroup": 71
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{
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"created_at": "2022-09-04T14:39:13.991322Z",
"structure_string": "Au1\n1.0\n0.000000 2.085644 2.085644\n2.085644 0.000000 2.085644\n2.085644 2.085644 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
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"spacegroup": 225
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{
"id": "mp-1185887",
"created_at": "2022-09-04T14:46:13.005342Z",
"structure_string": "Mg1 Hg5\n1.0\n3.037677 -5.261411 0.000000\n3.037677 5.261411 0.000000\n0.000000 0.000000 4.856729\nMg Hg\n1 5\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.689762 0.500000 Hg\n0.689762 0.000000 0.500000 Hg\n0.310238 0.310238 0.500000 Hg\n0.666667 0.333333 0.000000 Hg\n0.333333 0.666667 0.000000 Hg\n",
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"formula_full": "Mg1 Hg5",
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{
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"created_at": "2022-09-04T14:45:58.000667Z",
"structure_string": "Ag1 I1\n1.0\n5.179415 -8.971011 0.000000\n5.179415 8.971011 0.000000\n0.000000 0.000000 7.883519\nAg I\n1 1\ndirect\n0.000000 0.000000 0.997507 Ag\n0.000000 0.000000 0.672493 I\n",
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]
}