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{
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{
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{
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"structure_string": "Th2 Ga4\n1.0\n4.110009 0.000000 -1.140498\n-0.316480 4.097806 -1.140498\n-0.008157 -0.008811 7.946470\nTh Ga\n2 4\ndirect\n0.875000 0.625001 0.250000 Th\n0.125000 0.375001 0.750000 Th\n0.708277 0.958278 0.916555 Ga\n0.458277 0.208277 0.416555 Ga\n0.541723 0.791724 0.583445 Ga\n0.291723 0.041723 0.083445 Ga\n",
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{
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"created_at": "2022-09-04T14:37:10.416181Z",
"updated_at": "2022-09-04T14:37:10.416201Z",
"structure_string": "Th1 Fe2 Si2\n1.0\n3.790432 0.000000 -1.442541\n-0.548994 3.750464 -1.442541\n-0.031070 -0.035950 5.619512\nTh Fe Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.750000 0.250000 0.500000 Fe\n0.250001 0.749999 0.500000 Fe\n0.639006 0.639005 0.278012 Si\n0.360995 0.360994 0.721988 Si\n",
"nsites": 5,
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"formula_full": "Th1 Fe2 Si2",
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{
"id": "jvasp-10530",
"created_at": "2022-09-04T14:37:09.161901Z",
"updated_at": "2022-09-04T14:37:09.161920Z",
"structure_string": "Th1 Fe4 P12\n1.0\n6.413911 0.000000 -2.267660\n-3.206955 5.554610 -2.267660\n0.000000 0.000000 6.802980\nTh Fe P\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Th\n0.000000 0.500000 0.000000 Fe\n-0.000000 -0.000000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.649327 0.497179 0.847851 P\n0.847851 0.350674 0.198525 P\n0.649327 0.801475 0.152149 P\n0.497179 0.847851 0.649327 P\n0.152149 0.649326 0.801475 P\n0.502822 0.152149 0.350674 P\n0.350674 0.502821 0.152149 P\n0.152149 0.350674 0.502822 P\n0.801475 0.152149 0.649326 P\n0.198525 0.847851 0.350674 P\n0.350674 0.198525 0.847851 P\n0.847852 0.649326 0.497179 P\n",
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"formula_full": "Th1 Fe4 P12",
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{
"id": "jvasp-105383",
"created_at": "2022-09-04T14:36:59.280902Z",
"updated_at": "2022-09-04T14:36:59.280924Z",
"structure_string": "Th1 Fe1 Ni4\n1.0\n4.946009 0.000000 0.000000\n-2.473005 4.283369 0.000000\n-0.000000 -0.000000 3.992530\nTh Fe Ni\n1 1 4\ndirect\n0.666667 0.333333 -0.000000 Th\n0.000000 0.000000 0.000000 Fe\n0.333333 0.666667 -0.000000 Ni\n0.667206 0.833603 0.500000 Ni\n0.166397 0.332794 0.500000 Ni\n0.166396 0.833603 0.500000 Ni\n",
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{
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"created_at": "2022-09-04T14:38:12.520401Z",
"updated_at": "2022-09-04T14:38:12.520428Z",
"structure_string": "Th1 Fe2 Ge2\n1.0\n3.867717 0.000000 -1.439219\n-0.535549 3.830460 -1.439219\n-0.065837 -0.075682 5.739678\nTh Fe Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.250000 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.636768 0.636768 0.273537 Ge\n0.363231 0.363232 0.726464 Ge\n",
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{
"id": "jvasp-15018",
"created_at": "2022-09-04T14:36:47.212234Z",
"updated_at": "2022-09-04T14:36:47.212247Z",
"structure_string": "Th1 Fe5\n1.0\n2.534227 -4.389410 -0.000000\n2.534227 4.389410 0.000000\n-0.000000 -0.000000 3.990617\nTh Fe\n1 5\ndirect\n0.000000 0.000000 0.000000 Th\n0.500001 0.500001 0.500000 Fe\n0.333334 0.666668 0.000000 Fe\n0.666668 0.333334 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n",
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"formula_full": "Th1 Fe5",
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"spacegroup": 191
},
{
"id": "jvasp-109140",
"created_at": "2022-09-04T14:38:08.495274Z",
"updated_at": "2022-09-04T14:38:08.495300Z",
"structure_string": "Th1 Fe4 Ni1\n1.0\n4.985608 -0.000000 0.000000\n-2.492804 4.317664 0.000000\n-0.000000 -0.000000 4.095119\nTh Fe Ni\n1 4 1\ndirect\n0.666667 0.333333 -0.000000 Th\n0.663958 0.831978 0.500000 Fe\n0.168022 0.831978 0.500000 Fe\n0.168022 0.336043 0.500000 Fe\n0.333334 0.666666 -0.000000 Fe\n0.000000 0.000000 0.000000 Ni\n",
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{
"id": "jvasp-106719",
"created_at": "2022-09-04T14:37:02.212181Z",
"updated_at": "2022-09-04T14:37:02.212196Z",
"structure_string": "Th1 Fe3 Co2\n1.0\n4.870481 -0.000000 0.000000\n-2.435240 4.217961 0.000000\n0.000000 -0.000000 4.007367\nTh Fe Co\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.666666 0.333333 -0.000000 Co\n0.333333 0.666667 -0.000000 Co\n",
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{
"id": "jvasp-56302",
"created_at": "2022-09-04T14:37:52.867138Z",
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"structure_string": "Th2 Fe4 Si2 C2\n1.0\n3.896688 -0.000000 0.000000\n-1.948345 5.371637 -0.000000\n0.000000 -0.000000 6.815808\nTh Fe Si C\n2 4 2 2\ndirect\n0.941126 0.882250 0.250000 Th\n0.058876 0.117751 0.750000 Th\n0.663229 0.326457 0.060373 Fe\n0.663229 0.326457 0.439627 Fe\n0.336773 0.673544 0.939627 Fe\n0.336773 0.673544 0.560373 Fe\n0.223813 0.447625 0.250000 Si\n0.776189 0.552376 0.750000 Si\n0.500000 0.000000 0.500000 C\n0.500000 0.000000 0.000000 C\n",
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{
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"created_at": "2022-09-04T14:35:41.735100Z",
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"structure_string": "Th6 Fe24 P12\n1.0\n3.711848 0.000000 0.000000\n0.000000 10.707980 -0.000000\n0.000000 -0.000000 14.277972\nTh Fe P\n6 24 12\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.375956 0.225808 Th\n0.500000 0.624044 0.774192 Th\n0.500000 0.500000 0.500000 Th\n0.000000 0.124044 0.725808 Th\n0.000000 0.875957 0.274192 Th\n0.000000 0.432875 0.674982 Fe\n0.000000 0.567125 0.325018 Fe\n0.500000 0.932875 0.825018 Fe\n0.500000 0.067125 0.174982 Fe\n0.000000 0.822350 0.710192 Fe\n0.000000 0.177651 0.289808 Fe\n0.500000 0.322350 0.789808 Fe\n0.500000 0.240378 0.037384 Fe\n0.500000 0.766052 0.578139 Fe\n0.000000 0.733948 0.078139 Fe\n0.000000 0.266052 0.921861 Fe\n0.500000 0.908799 0.448411 Fe\n0.000000 0.922151 0.553531 Fe\n0.500000 0.677651 0.210192 Fe\n0.500000 0.233948 0.421861 Fe\n0.500000 0.759622 0.962616 Fe\n0.000000 0.259622 0.537384 Fe\n0.500000 0.422151 0.946469 Fe\n0.500000 0.091201 0.551589 Fe\n0.000000 0.408799 0.051589 Fe\n0.000000 0.591201 0.948411 Fe\n0.500000 0.577849 0.053531 Fe\n0.000000 0.077849 0.446469 Fe\n0.000000 0.740378 0.462616 Fe\n0.500000 0.149989 0.886312 P\n0.000000 0.350011 0.386312 P\n0.000000 0.649989 0.613688 P\n0.500000 0.701107 0.367120 P\n0.500000 0.298893 0.632880 P\n0.000000 0.429268 0.834015 P\n0.500000 0.929268 0.665985 P\n0.000000 0.570732 0.165985 P\n0.000000 0.201107 0.132880 P\n0.000000 0.798893 0.867120 P\n0.500000 0.070732 0.334015 P\n0.500000 0.850011 0.113688 P\n",
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}