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{
"id": "jvasp-91794",
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{
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{
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"structure_string": "Sc3 Ru1 C4\n1.0\n3.217553 -0.000000 -0.809623\n-0.374333 4.231836 -1.487650\n0.002576 -0.000270 6.808539\nSc Ru C\n3 1 4\ndirect\n0.810730 0.810730 0.621457 Sc\n0.189272 0.189271 0.378544 Sc\n0.000001 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Ru\n0.629541 0.787405 0.259080 C\n0.370460 0.212596 0.740921 C\n0.370461 0.528324 0.740921 C\n0.629541 0.471677 0.259080 C\n",
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"volume": 92.7135850204595,
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"formula_full": "Sc3 Ru1 C4",
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{
"id": "jvasp-37256",
"created_at": "2022-09-04T14:37:57.951630Z",
"updated_at": "2022-09-04T14:37:57.951657Z",
"structure_string": "Sc3 Sb1\n1.0\n-2.148909 2.148909 4.876693\n2.148909 -2.148909 4.876693\n2.148909 2.148909 -4.876693\nSc Sb\n3 1\ndirect\n0.750000 0.250000 0.500000 Sc\n0.250000 0.750000 0.500000 Sc\n0.500001 0.500001 0.000000 Sc\n0.000000 0.000000 0.000000 Sb\n",
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{
"id": "jvasp-87053",
"created_at": "2022-09-04T14:36:18.975382Z",
"updated_at": "2022-09-04T14:36:18.975406Z",
"structure_string": "Sc6 Si6 Ni2\n1.0\n3.937590 0.000000 0.649417\n1.936007 4.906128 0.523508\n0.005558 -0.004539 12.228347\nSc Si Ni\n6 6 2\ndirect\n0.600330 0.720306 0.079034 Sc\n0.473902 0.673126 0.379072 Sc\n0.742278 0.741883 0.773563 Sc\n0.526099 0.326874 0.620928 Sc\n0.399670 0.279694 0.920967 Sc\n0.257723 0.258117 0.226437 Sc\n0.962832 0.838114 0.236224 Si\n0.866543 0.721027 0.545888 Si\n0.133458 0.278974 0.454113 Si\n0.119436 0.836813 0.924317 Si\n0.037169 0.161886 0.763777 Si\n0.880564 0.163187 0.075683 Si\n0.243707 0.915171 0.597419 Ni\n0.756294 0.084829 0.402582 Ni\n",
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"id": "jvasp-21681",
"created_at": "2022-09-04T14:37:27.420360Z",
"updated_at": "2022-09-04T14:37:27.420382Z",
"structure_string": "Sc6 Si6 Ni4\n1.0\n3.984150 0.000000 0.000000\n-1.992074 4.844958 0.000000\n0.000000 0.000000 13.147496\nSc Si Ni\n6 6 4\ndirect\n0.082852 0.165704 0.888309 Sc\n0.917149 0.834297 0.111691 Sc\n0.917149 0.834297 0.388309 Sc\n0.361139 0.722277 0.750000 Sc\n0.082852 0.165704 0.611692 Sc\n0.638862 0.277724 0.250000 Sc\n0.342086 0.684171 0.250000 Si\n0.657915 0.315830 0.750000 Si\n0.383073 0.766144 0.539093 Si\n0.616928 0.233856 0.460907 Si\n0.616928 0.233856 0.039093 Si\n0.383073 0.766144 0.960907 Si\n0.207782 0.415563 0.402731 Ni\n0.792219 0.584437 0.597270 Ni\n0.207782 0.415563 0.097270 Ni\n0.792219 0.584437 0.902731 Ni\n",
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"formula_anonymous": "A2B3C3",
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"spacegroup": 63
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{
"id": "jvasp-120458",
"created_at": "2022-09-04T14:38:50.894479Z",
"updated_at": "2022-09-04T14:38:50.894505Z",
"structure_string": "Sc12 Si12 Pt4\n1.0\n4.038989 -0.000000 0.000000\n0.000000 10.253170 0.000000\n-0.000000 0.000000 11.718808\nSc Si Pt\n12 12 4\ndirect\n0.250000 0.875689 0.020393 Sc\n0.750000 0.157762 0.698938 Sc\n0.750000 0.342238 0.198938 Sc\n0.250000 0.842238 0.301063 Sc\n0.750000 0.420154 0.900398 Sc\n0.750000 0.079846 0.400398 Sc\n0.250000 0.657762 0.801063 Sc\n0.250000 0.920154 0.599602 Sc\n0.750000 0.375689 0.479607 Sc\n0.750000 0.124311 0.979607 Sc\n0.250000 0.624311 0.520393 Sc\n0.250000 0.579846 0.099602 Sc\n0.750000 0.747809 0.655705 Si\n0.750000 0.686268 0.957164 Si\n0.750000 0.813732 0.457164 Si\n0.250000 0.313732 0.042836 Si\n0.250000 0.186268 0.542836 Si\n0.750000 0.752191 0.155705 Si\n0.250000 0.482420 0.324535 Si\n0.250000 0.247809 0.844295 Si\n0.750000 0.517580 0.675465 Si\n0.750000 0.982420 0.175465 Si\n0.250000 0.017580 0.824535 Si\n0.250000 0.252191 0.344295 Si\n0.750000 0.613501 0.322970 Pt\n0.250000 0.386499 0.677030 Pt\n0.250000 0.113501 0.177030 Pt\n0.750000 0.886499 0.822970 Pt\n",
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{
"id": "jvasp-100617",
"created_at": "2022-09-04T14:36:56.429441Z",
"updated_at": "2022-09-04T14:36:56.429461Z",
"structure_string": "Sc6 Sn2\n1.0\n6.344969 -0.000000 0.000000\n-3.172484 5.494905 -0.000000\n0.000000 -0.000000 5.150267\nSc Sn\n6 2\ndirect\n0.168281 0.336562 0.250000 Sc\n0.663439 0.831720 0.250000 Sc\n0.168281 0.831720 0.250000 Sc\n0.831720 0.663439 0.750000 Sc\n0.336562 0.168281 0.750000 Sc\n0.831720 0.168281 0.750000 Sc\n0.333334 0.666668 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n",
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"volume": 179.56406865266953,
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{
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"updated_at": "2022-09-04T14:38:31.302782Z",
"structure_string": "Sc3 Sn1 B1\n1.0\n4.638316 -0.000000 0.000000\n0.000000 4.638316 0.000000\n-0.000000 0.000000 4.638316\nSc Sn B\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 B\n",
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{
"id": "jvasp-17391",
"created_at": "2022-09-04T14:38:29.075174Z",
"updated_at": "2022-09-04T14:38:29.075208Z",
"structure_string": "Sc3 Sn1 C1\n1.0\n4.518965 -0.000000 -0.000000\n0.000000 4.518965 -0.000000\n0.000000 -0.000000 4.518965\nSc Sn C\n3 1 1\ndirect\n0.000000 0.499999 0.499999 Sc\n0.499999 0.499999 0.000000 Sc\n0.499999 0.000000 0.499999 Sc\n0.000000 0.000000 0.000000 Sn\n0.499999 0.499999 0.499999 C\n",
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{
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{
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"created_at": "2022-09-04T14:36:38.885107Z",
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"structure_string": "Sc6 Te2\n1.0\n6.334108 0.000000 0.000000\n-3.167054 5.485499 0.000000\n-0.000000 -0.000000 5.098042\nSc Te\n6 2\ndirect\n0.166755 0.333509 0.250000 Sc\n0.666492 0.833246 0.250000 Sc\n0.166755 0.833246 0.250000 Sc\n0.833246 0.666491 0.750000 Sc\n0.333509 0.166755 0.750000 Sc\n0.833246 0.166755 0.750000 Sc\n0.333334 0.666667 0.750000 Te\n0.666667 0.333333 0.250000 Te\n",
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}