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{
"id": "oqmd-320735",
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"structure_string": "Np6 U2\n1.0\n5.764573 0.000000 0.000000\n-2.882286 4.992265 0.000000\n0.000000 0.000000 5.606009\nNp U\n6 2\ndirect\n0.166094 0.332188 0.250001 Np\n0.166093 0.833906 0.250001 Np\n0.667813 0.833906 0.250001 Np\n0.332187 0.166093 0.750001 Np\n0.833905 0.166093 0.750001 Np\n0.833904 0.667811 0.750001 Np\n0.666666 0.333332 0.250001 U\n0.333333 0.666665 0.750001 U\n",
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{
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"structure_string": "Yb1 Ir1 Os2\n1.0\n0.000000 3.164633 3.164633\n3.164633 0.000000 3.164633\n3.164633 3.164633 0.000000\nIr Os Yb\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Ir\n0.000000 0.000000 0.000000 Os\n0.500001 0.500001 0.500001 Os\n0.750000 0.750000 0.750000 Yb\n",
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{
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"structure_string": "Pu2 Ir1 W1\n1.0\n0.000000 3.324007 3.324007\n3.324007 0.000000 3.324007\n3.324007 3.324007 0.000000\nIr Pu W\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Ir\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Pu\n0.750000 0.750000 0.750000 W\n",
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{
"id": "oqmd-369824",
"created_at": "2022-09-04T14:52:31.234379Z",
"updated_at": "2022-09-04T14:52:31.234400Z",
"structure_string": "Hf1 Re1 Os2\n1.0\n0.000000 3.163993 3.163993\n3.163993 0.000000 3.163993\n3.163993 3.163993 0.000000\nHf Os Re\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Hf\n0.000000 0.000000 0.000000 Os\n0.500000 0.500000 0.500000 Os\n0.749998 0.749998 0.749998 Re\n",
"nsites": 4,
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"elements": [
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"volume": 63.348529431298225,
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"formula_full": "Hf1 Re1 Os2",
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{
"id": "oqmd-322146",
"created_at": "2022-09-04T14:50:58.011391Z",
"updated_at": "2022-09-04T14:50:58.011417Z",
"structure_string": "Lu2 Ir6\n1.0\n5.682752 0.000000 0.000000\n-2.841376 4.921407 0.000000\n0.000000 0.000000 4.569556\nIr Lu\n6 2\ndirect\n0.161891 0.323781 0.250000 Ir\n0.161893 0.838110 0.250000 Ir\n0.676217 0.838110 0.250000 Ir\n0.323783 0.161893 0.749998 Ir\n0.838109 0.161893 0.749998 Ir\n0.838108 0.676217 0.749998 Ir\n0.666666 0.333334 0.250000 Lu\n0.333334 0.666667 0.749998 Lu\n",
"nsites": 8,
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"formula_full": "Lu2 Ir6",
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"spacegroup": 194
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{
"id": "oqmd-1486170",
"created_at": "2022-09-04T15:52:59.092755Z",
"updated_at": "2022-09-04T15:52:59.092784Z",
"structure_string": "Ta2 Re11\n1.0\n2.547304 1.470687 9.116507\n-2.547304 1.470687 9.116507\n0.000000 -2.941373 9.116507\nRe Ta\n11 2\ndirect\n0.000000 0.000000 0.000000 Re\n0.585474 0.092314 0.092314 Re\n0.092314 0.585474 0.092314 Re\n0.347202 0.347202 0.347202 Re\n0.907686 0.907686 0.414526 Re\n0.455013 0.455013 0.455013 Re\n0.544987 0.544987 0.544987 Re\n0.092314 0.092314 0.585474 Re\n0.652798 0.652798 0.652798 Re\n0.907686 0.414526 0.907686 Re\n0.414526 0.907686 0.907686 Re\n0.166518 0.166518 0.166518 Ta\n0.833482 0.833482 0.833482 Ta\n",
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"formula_full": "Ta2 Re11",
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"spacegroup": 166
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{
"id": "oqmd-323184",
"created_at": "2022-09-04T14:50:57.297701Z",
"updated_at": "2022-09-04T14:50:57.297721Z",
"structure_string": "Pu6 Rh2\n1.0\n5.856687 0.000000 0.000000\n-2.928343 5.072039 0.000000\n0.000000 0.000000 4.779388\nPu Rh\n6 2\ndirect\n0.177423 0.354845 0.250001 Pu\n0.177422 0.822576 0.250001 Pu\n0.645154 0.822576 0.250001 Pu\n0.354846 0.177422 0.750000 Pu\n0.822576 0.177422 0.750000 Pu\n0.822577 0.645155 0.750000 Pu\n0.666665 0.333331 0.250001 Rh\n0.333333 0.666667 0.750000 Rh\n",
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"volume": 141.97336883044719,
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{
"id": "oqmd-1230593",
"created_at": "2022-09-04T15:39:27.982722Z",
"updated_at": "2022-09-04T15:39:27.982754Z",
"structure_string": "Pu1 Np1\n1.0\n2.825799 0.000512 0.000001\n-1.412456 2.447248 -0.000059\n0.000001 -0.000111 5.913371\nNp Pu\n1 1\ndirect\n0.666673 0.333330 0.749995 Np\n0.333330 0.666670 0.250004 Pu\n",
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"spacegroup": 187
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{
"id": "oqmd-312264",
"created_at": "2022-09-04T14:50:27.326182Z",
"updated_at": "2022-09-04T14:50:27.326204Z",
"structure_string": "U3 Re1\n1.0\n0.000000 3.370102 3.370102\n3.370102 0.000000 3.370102\n3.370102 3.370102 0.000000\nRe U\n1 3\ndirect\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 U\n0.250000 0.250000 0.250000 U\n0.500000 0.500000 0.500000 U\n",
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{
"id": "oqmd-298947",
"created_at": "2022-09-04T14:49:42.576357Z",
"updated_at": "2022-09-04T14:49:42.576383Z",
"structure_string": "Pu1 Pt3\n1.0\n-2.034626 2.034626 4.259067\n2.034626 -2.034626 4.259067\n2.034626 2.034626 -4.259067\nPt Pu\n3 1\ndirect\n0.500000 0.500000 0.000000 Pt\n0.750001 0.250000 0.500001 Pt\n0.250000 0.750001 0.500001 Pt\n0.000000 0.000000 0.000000 Pu\n",
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},
{
"id": "oqmd-993987",
"created_at": "2022-09-04T15:43:39.304046Z",
"updated_at": "2022-09-04T15:43:39.304074Z",
"structure_string": "Ti1 Rh2 W2\n1.0\n0.000000 2.978653 2.978653\n2.978653 0.000000 2.978653\n2.978653 2.978653 0.000000\nRh Ti W\n2 1 2\ndirect\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.750000 W\n",
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{
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"created_at": "2022-09-04T15:38:45.553910Z",
"updated_at": "2022-09-04T15:38:45.553939Z",
"structure_string": "Ir2 Os2 W1\n1.0\n-1.805304 1.805304 6.190761\n1.805304 -1.805304 6.190761\n1.805304 1.805304 -6.190761\nIr Os W\n2 2 1\ndirect\n0.401773 0.401773 0.000000 Ir\n0.598227 0.598227 0.000000 Ir\n0.750000 0.250000 0.500000 Os\n0.250000 0.750000 0.500000 Os\n0.000000 0.000000 0.000000 W\n",
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}