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{
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"results": [
{
"id": "mp-569708",
"created_at": "2022-09-04T14:46:23.892186Z",
"structure_string": "Ti7 Pt21\n1.0\n2.796229 -4.843211 0.000000\n2.796229 4.843211 0.000000\n0.000000 0.000000 15.956821\nTi Pt\n7 21\ndirect\n0.000000 0.000000 0.719223 Ti\n0.666667 0.333333 0.856585 Ti\n0.333333 0.666667 0.143415 Ti\n0.000000 0.000000 0.280777 Ti\n0.666667 0.333333 0.429472 Ti\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.570528 Ti\n0.833190 0.666380 0.571056 Pt\n0.333620 0.166810 0.571056 Pt\n0.166608 0.333216 0.856938 Pt\n0.166810 0.333620 0.428944 Pt\n0.166810 0.833190 0.428944 Pt\n0.500483 0.000965 0.713587 Pt\n0.666380 0.833190 0.428944 Pt\n0.166608 0.833392 0.856938 Pt\n0.666784 0.833392 0.856938 Pt\n0.833392 0.166608 0.143062 Pt\n0.833190 0.166810 0.571056 Pt\n0.500483 0.499517 0.713587 Pt\n0.333216 0.166608 0.143062 Pt\n0.833392 0.666784 0.143062 Pt\n0.499517 0.500483 0.286413 Pt\n0.499517 0.999035 0.286413 Pt\n0.500000 0.000000 0.000000 Pt\n0.000965 0.500483 0.286413 Pt\n0.999035 0.499517 0.713587 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n",
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{
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"structure_string": "Ti1 Pt3\n1.0\n3.951971 0.000000 0.000000\n0.000000 3.951971 0.000000\n0.000000 0.000000 3.951971\nTi Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
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"updated_at": "2021-11-28T01:36:26.761000Z",
"spacegroup": 221
},
{
"id": "mp-1007786",
"created_at": "2022-09-04T14:41:00.891386Z",
"structure_string": "Hf2 Ir2\n1.0\n4.482867 0.000000 0.000000\n0.000000 3.169103 0.000000\n0.000000 1.673703 5.086373\nHf Ir\n2 2\ndirect\n0.750000 0.649113 0.213328 Hf\n0.250000 0.350887 0.786672 Hf\n0.750000 0.902957 0.684062 Ir\n0.250000 0.097043 0.315938 Ir\n",
"nsites": 4,
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"density": 17.03764111781878,
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"volume": 72.26040876260622,
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"formula_full": "Hf2 Ir2",
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"energy": -41.38319548,
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"updated_at": "2021-11-28T01:35:12.133000Z",
"spacegroup": 11
},
{
"id": "mp-1226226",
"created_at": "2022-09-04T14:39:08.432487Z",
"structure_string": "Cr1 Re5 B2\n1.0\n1.454698 -4.666202 0.000000\n1.454698 4.666202 0.000000\n0.000000 0.000000 7.212172\nCr Re B\n1 5 2\ndirect\n0.574869 0.425131 0.000000 Cr\n0.868062 0.131938 0.182118 Re\n0.136915 0.863085 0.304293 Re\n0.868062 0.131938 0.817882 Re\n0.136915 0.863085 0.695707 Re\n0.427197 0.572803 0.500000 Re\n0.244777 0.755223 0.000000 B\n0.743204 0.256796 0.500000 B\n",
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"formula_full": "Cr1 Re5 B2",
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"energy": -86.89261431,
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"spacegroup": 38
},
{
"id": "mp-1186826",
"created_at": "2022-09-04T14:48:12.229061Z",
"structure_string": "Pu3 Ta1\n1.0\n-2.262418 2.262418 4.345358\n2.262418 -2.262418 4.345358\n2.262418 2.262418 -4.345358\nPu Ta\n3 1\ndirect\n0.750000 0.250000 0.500000 Pu\n0.250000 0.750000 0.500000 Pu\n0.500000 0.500000 0.000000 Pu\n0.000000 0.000000 0.000000 Ta\n",
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"formula_full": "Pu3 Ta1",
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"updated_at": "2021-11-28T01:38:27.824000Z",
"spacegroup": 139
},
{
"id": "mp-1189793",
"created_at": "2022-09-04T14:43:00.601103Z",
"structure_string": "Ti4 Pt12\n1.0\n2.796474 -4.843635 0.000000\n2.796474 4.843635 0.000000\n0.000000 0.000000 9.109496\nTi Pt\n4 12\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.250000 Ti\n0.666667 0.333333 0.750000 Ti\n0.500000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n0.833424 0.666849 0.250000 Pt\n0.333151 0.166576 0.250000 Pt\n0.833424 0.166576 0.250000 Pt\n0.166576 0.333151 0.750000 Pt\n0.666849 0.833424 0.750000 Pt\n0.166576 0.833424 0.750000 Pt\n",
"nsites": 16,
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"elements": [
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"chemical_system": "Pt-Ti",
"density": 17.040718253848084,
"density_atomic": 0.06483558636631562,
"volume": 246.77805656914006,
"volume_molar": 9.288326207116276,
"formula_full": "Ti4 Pt12",
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"energy": -117.97446873,
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"updated_at": "2021-11-28T01:36:07.202000Z",
"spacegroup": 194
},
{
"id": "mp-569264",
"created_at": "2022-09-04T14:41:12.758383Z",
"structure_string": "Nd1 Ir5\n1.0\n2.679934 -4.641781 0.000000\n2.679934 4.641781 0.000000\n0.000000 0.000000 4.328851\nNd Ir\n1 5\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Ir\n0.666667 0.333333 0.000000 Ir\n0.000000 0.500000 0.500000 Ir\n0.333333 0.666667 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n",
"nsites": 6,
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],
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"density": 17.042311452078977,
"density_atomic": 0.05571086120703471,
"volume": 107.69892746232344,
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"formula_full": "Nd1 Ir5",
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"formula_anonymous": "AB5",
"energy": -50.62945595,
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"updated_at": "2021-11-28T01:35:17.358000Z",
"spacegroup": 191
},
{
"id": "mp-972220",
"created_at": "2022-09-04T14:42:44.197267Z",
"structure_string": "Ti2 Pt6\n1.0\n2.806152 -4.860398 0.000000\n2.806152 4.860398 0.000000\n0.000000 0.000000 4.521593\nTi Pt\n2 6\ndirect\n0.333333 0.666667 0.750000 Ti\n0.666667 0.333333 0.250000 Ti\n0.167396 0.334793 0.250000 Pt\n0.665207 0.832604 0.250000 Pt\n0.167396 0.832604 0.250000 Pt\n0.832604 0.665207 0.750000 Pt\n0.334793 0.167396 0.750000 Pt\n0.832604 0.167396 0.750000 Pt\n",
"nsites": 8,
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"elements": [
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"density": 17.0474706530304,
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"volume": 123.34015464280506,
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"formula_full": "Ti2 Pt6",
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"spacegroup": 194
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{
"id": "mp-1186163",
"created_at": "2022-09-04T14:39:41.843654Z",
"structure_string": "Np3 As1\n1.0\n-2.135863 2.135863 4.186993\n2.135863 -2.135863 4.186993\n2.135863 2.135863 -4.186993\nNp As\n3 1\ndirect\n0.750000 0.250000 0.500000 Np\n0.250000 0.750000 0.500000 Np\n0.500000 0.500000 0.000000 Np\n0.000000 0.000000 0.000000 As\n",
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{
"id": "mp-1223860",
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"structure_string": "Ir1 Ru1\n1.0\n4.523543 -1.358693 0.000000\n4.523543 1.358693 0.000000\n4.115445 0.000000 2.317670\nIr Ru\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ru\n",
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{
"id": "mp-1220023",
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"structure_string": "Os1 Ru1\n1.0\n1.371928 -2.376249 0.000000\n1.371928 2.376249 0.000000\n0.000000 0.000000 4.339649\nOs Ru\n1 1\ndirect\n0.666667 0.333333 0.500000 Os\n0.333333 0.666667 0.000000 Ru\n",
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"updated_at": "2021-11-28T01:36:43.639000Z",
"spacegroup": 187
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{
"id": "mp-974421",
"created_at": "2022-09-04T14:42:10.190777Z",
"structure_string": "Ir1 Ru1\n1.0\n1.372530 -2.377292 0.000000\n1.372530 2.377292 0.000000\n0.000000 0.000000 4.363817\nIr Ru\n1 1\ndirect\n0.000000 0.000000 0.500000 Ir\n0.666667 0.333333 0.000000 Ru\n",
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}
]
}