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{
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{
"id": "jvasp-42268",
"created_at": "2022-09-04T14:36:18.426890Z",
"updated_at": "2022-09-04T14:36:18.426904Z",
"structure_string": "Li4 Mn4 Si4 O16\n1.0\n4.778685 0.000000 0.000000\n0.000000 6.201839 0.000000\n0.000000 0.000000 9.991484\nLi Mn Si O\n4 4 4 16\ndirect\n0.056126 0.006586 0.219081 Li\n0.443873 0.006586 0.719081 Li\n0.556126 0.506586 0.280919 Li\n0.943873 0.506586 0.780919 Li\n0.000002 0.256522 0.499996 Mn\n0.499997 0.256522 -0.000004 Mn\n0.500002 0.756522 0.000004 Mn\n-0.000002 0.756522 0.500004 Mn\n0.906305 0.006521 0.905884 Si\n0.593694 0.006521 0.405884 Si\n0.406305 0.506521 0.594115 Si\n0.093694 0.506521 0.094116 Si\n0.754978 0.229428 0.850288 O\n0.742905 0.506520 0.594594 O\n0.757094 0.506520 0.094594 O\n0.745021 0.229428 0.350288 O\n0.745004 0.783600 0.350304 O\n0.759655 0.006526 0.558870 O\n0.240344 0.506526 0.441129 O\n0.245004 0.283599 0.149696 O\n0.254978 0.729428 0.649711 O\n0.242905 0.006519 0.905406 O\n0.257094 0.006519 0.405406 O\n0.245021 0.729428 0.149712 O\n0.754995 0.783600 0.850304 O\n0.259655 0.506526 0.941129 O\n0.254995 0.283599 0.649696 O\n0.740344 0.006526 0.058871 O\n",
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{
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"structure_string": "Dy1 Al2 Si2\n1.0\n2.109766 -3.654222 -0.000000\n2.109766 3.654222 0.000000\n0.000000 0.000000 6.579393\nDy Al Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.666668 0.333334 0.646239 Al\n0.333334 0.666668 0.353761 Al\n0.666668 0.333334 0.259006 Si\n0.333334 0.666668 0.740993 Si\n",
"nsites": 5,
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"formula_full": "Dy1 Al2 Si2",
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{
"id": "jvasp-69497",
"created_at": "2022-09-04T14:36:18.430808Z",
"updated_at": "2022-09-04T14:36:18.430823Z",
"structure_string": "Be2 Co1 Pb1\n1.0\n3.050123 -0.000000 -0.000000\n0.000000 3.050123 -0.000000\n0.000000 0.000000 6.040876\nBe Co Pb\n2 1 1\ndirect\n0.000000 0.000000 0.077849 Be\n0.499999 0.499999 0.271213 Be\n0.000000 0.000000 0.410193 Co\n0.499999 0.499999 0.740747 Pb\n",
"nsites": 4,
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"volume": 56.19978155065522,
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"formula_anonymous": "ABC2",
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"spacegroup": 99
},
{
"id": "jvasp-16058",
"created_at": "2022-09-04T14:36:18.433843Z",
"updated_at": "2022-09-04T14:36:18.433862Z",
"structure_string": "Li3 Yb3 Ge3\n1.0\n3.489466 -6.043933 0.000000\n3.489466 6.043933 0.000000\n-0.000000 -0.000000 4.477438\nYb Li Ge\n3 3 3\ndirect\n0.431375 0.000000 0.000000 Yb\n0.568626 0.568626 0.000000 Yb\n0.000000 0.431375 0.000000 Yb\n0.227014 0.227014 0.500000 Li\n0.000001 0.772987 0.500000 Li\n0.772987 0.000001 0.500000 Li\n0.333334 0.666668 0.500000 Ge\n0.666668 0.333334 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 9,
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"spacegroup": 189
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{
"id": "jvasp-64929",
"created_at": "2022-09-04T14:36:18.438195Z",
"updated_at": "2022-09-04T14:36:18.438227Z",
"structure_string": "Be1 Co4 Pb1\n1.0\n0.000000 3.403109 3.403109\n3.403109 0.000000 3.403109\n3.403109 3.403109 0.000000\nBe Co Pb\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.373829 0.373829 0.373829 Co\n0.373829 0.878514 0.373829 Co\n0.373829 0.373829 0.878514 Co\n0.878514 0.373829 0.373829 Co\n0.750000 0.750000 0.750000 Pb\n",
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{
"id": "jvasp-68617",
"created_at": "2022-09-04T14:36:18.440112Z",
"updated_at": "2022-09-04T14:36:18.440136Z",
"structure_string": "Zr1 Be2 Ir2\n1.0\n-2.027023 2.027023 4.221325\n2.027023 -2.027023 4.221325\n2.027023 2.027023 -4.221325\nZr Be Ir\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.631485 0.631485 0.000000 Be\n0.368514 0.368514 0.000000 Be\n0.749999 0.250000 0.499999 Ir\n0.250000 0.749999 0.499999 Ir\n",
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{
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"created_at": "2022-09-04T14:36:18.441380Z",
"updated_at": "2022-09-04T14:36:18.441416Z",
"structure_string": "Li2 Fe2 O6\n1.0\n2.774150 -0.000111 0.000100\n-1.386933 5.213133 -0.468070\n-0.000374 -2.257217 6.664927\nLi Fe O\n2 2 6\ndirect\n0.624180 0.748335 0.364129 Li\n0.375823 0.251665 0.635871 Li\n0.812218 0.124425 0.192101 Fe\n0.187784 0.875574 0.807900 Fe\n0.995668 0.491317 0.395111 O\n0.004334 0.508682 0.604890 O\n0.360409 0.220793 0.048509 O\n0.255495 0.010993 0.319611 O\n0.639592 0.779207 -0.048509 O\n0.744507 0.989006 0.680390 O\n",
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"volume": 93.45655937794412,
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"formula_full": "Li2 Fe2 O6",
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"formula_anonymous": "ABC3",
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"spacegroup": 12
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{
"id": "jvasp-90767",
"created_at": "2022-09-04T14:36:18.442045Z",
"updated_at": "2022-09-04T14:36:18.442073Z",
"structure_string": "Hf6 Mg2\n1.0\n4.372910 0.000000 0.000000\n-0.000000 4.372910 0.000000\n0.000000 0.000000 8.955254\nHf Mg\n6 2\ndirect\n0.500000 0.500000 0.000000 Hf\n0.500000 0.000000 0.250000 Hf\n0.000000 0.500000 0.250000 Hf\n0.000000 0.000000 0.500000 Hf\n0.000000 0.500000 0.750000 Hf\n0.500000 0.000000 0.750000 Hf\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n",
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{
"id": "jvasp-86626",
"created_at": "2022-09-04T14:36:18.444100Z",
"updated_at": "2022-09-04T14:36:18.444119Z",
"structure_string": "Sc1 Cr2 Ag1 H4 O10\n1.0\n5.626055 0.004443 -0.028490\n-2.800996 4.923245 -2.129153\n-0.012480 -0.033934 7.320560\nSc Cr Ag H O\n1 2 1 4 10\ndirect\n0.000000 0.000000 0.000000 Sc\n0.637338 0.236744 0.317790 Cr\n0.362663 0.763257 0.682210 Cr\n0.000000 0.000000 0.500000 Ag\n0.240193 0.490953 0.955677 H\n0.702708 0.436454 0.800378 H\n0.759807 0.509048 0.044324 H\n0.297292 0.563547 0.199623 H\n0.167363 0.918448 0.742528 O\n0.779378 0.580335 0.938814 O\n0.220622 0.419666 0.061187 O\n0.608387 0.298043 0.548987 O\n0.832637 0.081553 0.257473 O\n0.677713 0.966965 0.828898 O\n0.322288 0.033036 0.171103 O\n0.211403 0.475646 0.712303 O\n0.788597 0.524355 0.287698 O\n0.391614 0.701958 0.451014 O\n",
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{
"id": "jvasp-63053",
"created_at": "2022-09-04T14:36:18.444483Z",
"updated_at": "2022-09-04T14:36:18.444499Z",
"structure_string": "Sc1 Ni4 Au1\n1.0\n0.000000 3.409932 3.409932\n3.409932 -0.000000 3.409932\n3.409932 3.409932 -0.000000\nSc Ni Au\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.375166 0.375166 0.375166 Ni\n0.375166 0.375166 0.874499 Ni\n0.874499 0.375166 0.375166 Ni\n0.375166 0.874499 0.375166 Ni\n0.750000 0.750000 0.750000 Au\n",
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{
"id": "jvasp-43175",
"created_at": "2022-09-04T14:36:18.445155Z",
"updated_at": "2022-09-04T14:36:18.445185Z",
"structure_string": "Li4 Fe3 O8\n1.0\n5.559865 -0.000884 -0.003264\n-2.779242 4.815310 0.003318\n-2.777750 -1.605612 5.034034\nLi Fe O\n4 3 8\ndirect\n0.994958 0.998101 0.993063 Li\n0.286851 0.644026 0.930915 Li\n0.999613 0.500396 0.500021 Li\n0.717980 0.359668 0.077613 Li\n0.495696 0.004640 0.500347 Fe\n0.008116 0.004657 0.500336 Fe\n0.495677 0.492224 0.500342 Fe\n0.536532 0.768883 0.305391 O\n0.030576 0.254431 0.284985 O\n0.507608 0.254428 0.285008 O\n0.030592 0.777407 0.285000 O\n0.474643 0.237876 0.712549 O\n0.962079 0.742821 0.704927 O\n0.484487 0.742805 0.704943 O\n0.962099 0.220413 0.704934 O\n",
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{
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"updated_at": "2022-09-04T14:36:18.448627Z",
"structure_string": "Ba4 Sb1 Os1\n1.0\n-0.000000 4.786833 4.786833\n4.786833 0.000000 4.786833\n4.786833 4.786833 -0.000000\nBa Sb Os\n4 1 1\ndirect\n0.125885 0.624705 0.624705 Ba\n0.624705 0.624705 0.624705 Ba\n0.624705 0.125885 0.624705 Ba\n0.624705 0.624705 0.125885 Ba\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Os\n",
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