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{
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"results": [
{
"id": "mp-1185918",
"created_at": "2022-09-04T14:43:42.003945Z",
"structure_string": "Mg1 In5\n1.0\n1.762251 5.882944 0.000000\n-1.762251 5.882944 0.000000\n0.000000 2.687476 7.661007\nMg In\n1 5\ndirect\n0.610315 0.610315 0.277929 Mg\n0.002502 0.002502 0.008475 In\n0.284008 0.284008 0.944276 In\n0.663528 0.663528 0.670832 In\n0.946337 0.946337 0.600326 In\n0.326641 0.326641 0.331495 In\n",
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{
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"updated_at": "2021-11-28T01:35:23.094000Z",
"spacegroup": 221
},
{
"id": "mp-1185850",
"created_at": "2022-09-04T14:41:20.393863Z",
"structure_string": "Mg1 Cd1 Pd2\n1.0\n0.000000 3.239948 3.239948\n3.239948 0.000000 3.239948\n3.239948 3.239948 0.000000\nMg Cd Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Cd\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pd\n",
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"density": 8.533392913695504,
"density_atomic": 0.05880521954069723,
"volume": 68.02117280136548,
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"formula_full": "Mg1 Cd1 Pd2",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:17.815000Z",
"spacegroup": 225
},
{
"id": "mp-862332",
"created_at": "2022-09-04T14:47:55.953401Z",
"structure_string": "La2 Hg6\n1.0\n3.455437 -5.984992 0.000000\n3.455437 5.984992 0.000000\n0.000000 0.000000 5.172101\nLa Hg\n2 6\ndirect\n0.333333 0.666667 0.250000 La\n0.666667 0.333333 0.750000 La\n0.837793 0.162207 0.250000 Hg\n0.837793 0.675585 0.250000 Hg\n0.324415 0.162207 0.250000 Hg\n0.162207 0.837793 0.750000 Hg\n0.162207 0.324415 0.750000 Hg\n0.675585 0.837793 0.750000 Hg\n",
"nsites": 8,
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"elements": [
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"chemical_system": "Hg-La",
"density": 11.498561399594136,
"density_atomic": 0.03739611104430847,
"volume": 213.92598793284324,
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"formula_full": "La2 Hg6",
"formula_reduced": "LaHg3",
"formula_anonymous": "AB3",
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"updated_at": "2021-11-28T01:38:15.435000Z",
"spacegroup": 194
},
{
"id": "mp-22473",
"created_at": "2022-09-04T14:47:36.226143Z",
"structure_string": "Na1 In1 Se2\n1.0\n7.157599 -2.018636 0.000000\n7.157599 2.018636 0.000000\n6.588290 0.000000 3.449718\nNa In Se\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 In\n0.740320 0.740320 0.740320 Se\n0.259680 0.259680 0.259680 Se\n",
"nsites": 4,
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"elements": [
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"chemical_system": "In-Na-Se",
"density": 4.9260888025684775,
"density_atomic": 0.04012555229129144,
"volume": 99.68710140017515,
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"formula_full": "Na1 In1 Se2",
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"energy_uncorrected": -14.23733457,
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"total_magnetization": 3.3e-06,
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"updated_at": "2021-11-28T01:38:11.197000Z",
"spacegroup": 166
},
{
"id": "mp-1097411",
"created_at": "2022-09-04T14:43:34.127954Z",
"structure_string": "Ga1 Sn1 Ru2\n1.0\n-4.986511 5.526028 7.832858\n4.986511 -5.526028 7.832858\n4.986511 5.526028 -7.832858\nGa Sn Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Sn\n0.000000 0.246131 0.246131 Ru\n0.000000 0.753869 0.753869 Ru\n",
"nsites": 4,
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"elements": [
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"Sn",
"Ru"
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"chemical_system": "Ga-Ru-Sn",
"density": 0.7512097357034585,
"density_atomic": 0.0046330809044680355,
"volume": 863.3563890806424,
"volume_molar": 129.98134252722392,
"formula_full": "Ga1 Sn1 Ru2",
"formula_reduced": "GaSnRu2",
"formula_anonymous": "ABC2",
"energy": -15.18011943,
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"energy_uncorrected": -15.18011943,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:14.765000Z",
"spacegroup": 71
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{
"id": "mp-864800",
"created_at": "2022-09-04T14:44:19.805649Z",
"structure_string": "Yb2 Pd1 Au1\n1.0\n0.000000 3.530127 3.530127\n3.530127 0.000000 3.530127\n3.530127 3.530127 0.000000\nYb Pd Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
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"elements": [
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"Pd",
"Au"
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"chemical_system": "Au-Pd-Yb",
"density": 12.25758498698048,
"density_atomic": 0.045463095850138364,
"volume": 87.9834495474163,
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"formula_full": "Yb2 Pd1 Au1",
"formula_reduced": "Yb2PdAu",
"formula_anonymous": "ABC2",
"energy": -15.17991054,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.102000Z",
"spacegroup": 225
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{
"id": "mp-976596",
"created_at": "2022-09-04T14:42:05.681902Z",
"structure_string": "Li1 Lu2 Ga1\n1.0\n0.000000 3.523705 3.523705\n3.523705 0.000000 3.523705\n3.523705 3.523705 0.000000\nLi Lu Ga\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Lu\n0.750000 0.750000 0.750000 Lu\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 4,
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"elements": [
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"Lu",
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],
"chemical_system": "Ga-Li-Lu",
"density": 8.095418198793922,
"density_atomic": 0.04571212047037279,
"volume": 87.50414460848526,
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"formula_full": "Li1 Lu2 Ga1",
"formula_reduced": "LiLu2Ga",
"formula_anonymous": "ABC2",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:34.253000Z",
"spacegroup": 225
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{
"id": "mp-862631",
"created_at": "2022-09-04T14:40:02.531255Z",
"structure_string": "Ba2 Sb1 Au1\n1.0\n0.000000 4.162596 4.162596\n4.162596 0.000000 4.162596\n4.162596 4.162596 0.000000\nBa Sb Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
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"elements": [
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"Sb",
"Au"
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"chemical_system": "Au-Ba-Sb",
"density": 6.8306122839255625,
"density_atomic": 0.02772919156036616,
"volume": 144.25231227142132,
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"formula_full": "Ba2 Sb1 Au1",
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"updated_at": "2021-11-28T01:34:46.154000Z",
"spacegroup": 225
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{
"id": "mp-1096320",
"created_at": "2022-09-04T14:48:02.068589Z",
"structure_string": "Y2 Mg1 Ir1\n1.0\n-5.765222 6.212548 8.647013\n5.765222 -6.212548 8.647013\n5.765222 6.212548 -8.647013\nY Mg Ir\n2 1 1\ndirect\n0.000000 0.288947 0.288947 Y\n0.000000 0.711053 0.711053 Y\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
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"density": 0.5285682781066949,
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"volume": 1238.8305186841867,
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"formula_full": "Y2 Mg1 Ir1",
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"updated_at": "2021-11-28T01:38:25.387000Z",
"spacegroup": 71
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{
"id": "mp-863258",
"created_at": "2022-09-04T14:42:45.552895Z",
"structure_string": "Sr2 As1 Au1\n1.0\n0.000000 3.836787 3.836787\n3.836787 0.000000 3.836787\n3.836787 3.836787 0.000000\nSr As Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Au\n",
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"updated_at": "2021-11-28T01:35:52.421000Z",
"spacegroup": 225
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{
"id": "mp-1187176",
"created_at": "2022-09-04T14:43:11.480136Z",
"structure_string": "Sr2 Ca6\n1.0\n3.986470 -6.904769 0.000000\n3.986470 6.904769 0.000000\n0.000000 0.000000 6.578790\nSr Ca\n2 6\ndirect\n0.333333 0.666667 0.750000 Sr\n0.666667 0.333333 0.250000 Sr\n0.164274 0.328547 0.250000 Ca\n0.671453 0.835726 0.250000 Ca\n0.164274 0.835726 0.250000 Ca\n0.835726 0.671453 0.750000 Ca\n0.328547 0.164274 0.750000 Ca\n0.835726 0.164274 0.750000 Ca\n",
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"formula_full": "Sr2 Ca6",
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"updated_at": "2021-11-28T01:36:19.411000Z",
"spacegroup": 194
}
]
}