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{
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"results": [
{
"id": "mp-1078755",
"created_at": "2022-09-04T14:45:30.246182Z",
"structure_string": "Sb2 Pt6\n1.0\n-2.002539 2.002539 8.618667\n2.002539 -2.002539 8.618667\n2.002539 2.002539 -8.618667\nSb Pt\n2 6\ndirect\n0.864344 0.864344 0.000000 Sb\n0.135656 0.135656 0.000000 Sb\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.750000 0.250000 0.500000 Pt\n0.250000 0.750000 0.500000 Pt\n0.614266 0.614266 0.000000 Pt\n0.385734 0.385734 0.000000 Pt\n",
"nsites": 8,
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{
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{
"id": "mp-10116",
"created_at": "2022-09-04T14:39:39.693343Z",
"structure_string": "U1 B2 Ir3\n1.0\n2.735302 -4.737682 0.000000\n2.735302 4.737682 0.000000\n0.000000 0.000000 3.154215\nU B Ir\n1 2 3\ndirect\n0.000000 0.000000 0.000000 U\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 6,
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"elements": [
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"Ir"
],
"chemical_system": "B-Ir-U",
"density": 16.98711816521815,
"density_atomic": 0.0733936982636203,
"volume": 81.7508879093244,
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"formula_full": "U1 B2 Ir3",
"formula_reduced": "UB2Ir3",
"formula_anonymous": "AB2C3",
"energy": -54.23739565000001,
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"updated_at": "2021-11-28T01:34:33.429000Z",
"spacegroup": 191
},
{
"id": "mp-981662",
"created_at": "2022-09-04T14:48:25.961239Z",
"structure_string": "Yb1 U3\n1.0\n4.425951 0.000000 0.000000\n0.000000 4.425951 0.000000\n0.000000 0.000000 4.425951\nYb U\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.000000 0.500000 0.500000 U\n0.500000 0.000000 0.500000 U\n0.500000 0.500000 0.000000 U\n",
"nsites": 4,
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"elements": [
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"chemical_system": "U-Yb",
"density": 16.990844219712233,
"density_atomic": 0.046136026386083294,
"volume": 86.7001411549084,
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"formula_full": "Yb1 U3",
"formula_reduced": "YbU3",
"formula_anonymous": "AB3",
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"updated_at": "2021-11-28T01:39:08.490000Z",
"spacegroup": 221
},
{
"id": "mp-1183680",
"created_at": "2022-09-04T14:48:30.572706Z",
"structure_string": "Co1 W3\n1.0\n3.907351 0.000000 0.000000\n0.000000 3.907351 0.000000\n0.000000 0.000000 3.907351\nCo W\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 W\n0.500000 0.000000 0.500000 W\n0.500000 0.500000 0.000000 W\n",
"nsites": 4,
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"elements": [
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"volume": 59.65505876247916,
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"formula_full": "Co1 W3",
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"band_gap": 0.0,
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"total_magnetization": 0.0271078,
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"updated_at": "2021-11-28T01:39:48.036000Z",
"spacegroup": 221
},
{
"id": "mp-1495",
"created_at": "2022-09-04T14:39:20.057078Z",
"structure_string": "Er2 Ir4\n1.0\n0.000000 3.777606 3.777606\n3.777606 0.000000 3.777606\n3.777606 3.777606 0.000000\nEr Ir\n2 4\ndirect\n0.250000 0.250000 0.250000 Er\n0.000000 0.000000 0.000000 Er\n0.625000 0.125000 0.625000 Ir\n0.625000 0.625000 0.125000 Ir\n0.125000 0.625000 0.625000 Ir\n0.625000 0.625000 0.625000 Ir\n",
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"elements": [
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"Ir"
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"density": 16.994038290169737,
"density_atomic": 0.05565078260895021,
"volume": 107.81519537939133,
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"formula_full": "Er2 Ir4",
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"formula_anonymous": "AB2",
"energy": -49.54379712,
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"updated_at": "2021-11-28T01:34:38.874000Z",
"spacegroup": 227
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{
"id": "mp-1100763",
"created_at": "2022-09-04T14:47:02.007418Z",
"structure_string": "Pt3 F1\n1.0\n0.000000 3.090403 3.090403\n3.090403 0.000000 3.090403\n3.090403 3.090403 0.000000\nPt F\n3 1\ndirect\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Pt\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 F\n",
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"elements": [
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"F"
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"chemical_system": "F-Pt",
"density": 16.997721157500717,
"density_atomic": 0.06776175499625968,
"volume": 59.030348316993745,
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"formula_full": "Pt3 F1",
"formula_reduced": "Pt3F",
"formula_anonymous": "AB3",
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"updated_at": "2021-11-28T01:37:53.775000Z",
"spacegroup": 225
},
{
"id": "mp-1183320",
"created_at": "2022-09-04T14:41:01.838345Z",
"structure_string": "As2 Pt6\n1.0\n2.793521 -4.838520 0.000000\n2.793521 4.838520 0.000000\n0.000000 0.000000 4.770865\nAs Pt\n2 6\ndirect\n0.333333 0.666667 0.750000 As\n0.666667 0.333333 0.250000 As\n0.166470 0.332940 0.250000 Pt\n0.667060 0.833530 0.250000 Pt\n0.166470 0.833530 0.250000 Pt\n0.833530 0.667060 0.750000 Pt\n0.332940 0.166470 0.750000 Pt\n0.833530 0.166470 0.750000 Pt\n",
"nsites": 8,
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"density": 16.999871631563895,
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"formula_full": "As2 Pt6",
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"updated_at": "2021-11-28T01:35:10.915000Z",
"spacegroup": 194
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{
"id": "mp-865785",
"created_at": "2022-09-04T14:45:25.890399Z",
"structure_string": "Yb1 Hf1 Ir2\n1.0\n0.000000 3.299618 3.299618\n3.299618 0.000000 3.299618\n3.299618 3.299618 0.000000\nYb Hf Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Hf\n0.750000 0.750000 0.750000 Ir\n0.250000 0.250000 0.250000 Ir\n",
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"elements": [
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"Hf",
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"density": 17.00923105482413,
"density_atomic": 0.05567227944133816,
"volume": 71.84904300918372,
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"formula_full": "Yb1 Hf1 Ir2",
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"updated_at": "2021-11-28T01:37:01.057000Z",
"spacegroup": 225
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{
"id": "mp-973354",
"created_at": "2022-09-04T14:44:17.748592Z",
"structure_string": "Sb1 Pt3\n1.0\n-2.024184 2.024184 4.209845\n2.024184 -2.024184 4.209845\n2.024184 2.024184 -4.209845\nSb Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Sb\n0.750000 0.250000 0.500000 Pt\n0.250000 0.750000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
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"updated_at": "2021-11-28T01:36:32.600000Z",
"spacegroup": 139
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{
"id": "mp-569249",
"created_at": "2022-09-04T14:45:23.237151Z",
"structure_string": "Ta6 Au2\n1.0\n5.246175 0.000000 0.000000\n0.000000 5.246175 0.000000\n0.000000 0.000000 5.246175\nTa Au\n6 2\ndirect\n0.500000 0.250000 0.000000 Ta\n0.000000 0.500000 0.750000 Ta\n0.750000 0.000000 0.500000 Ta\n0.500000 0.750000 0.000000 Ta\n0.000000 0.500000 0.250000 Ta\n0.250000 0.000000 0.500000 Ta\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n",
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{
"id": "mp-1223919",
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"structure_string": "Ir1 Rh1\n1.0\n4.528352 -1.365026 0.000000\n4.528352 1.365026 0.000000\n4.116878 0.000000 2.328214\nIr Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Rh\n",
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"updated_at": "2021-11-28T01:36:31.220000Z",
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]
}