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{
"id": "jvasp-100433",
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"structure_string": "Al3 Si1 Pd4\n1.0\n4.894493 -0.001865 -0.052621\n-0.053170 4.894204 -0.052621\n-0.001846 -0.001865 4.894775\nAl Si Pd\n3 1 4\ndirect\n0.341365 0.158427 0.649972 Al\n0.158427 0.649970 0.341367 Al\n0.649971 0.341365 0.158428 Al\n0.843739 0.843738 0.843742 Si\n0.144284 0.144284 0.144284 Pd\n0.655623 0.850264 0.356321 Pd\n0.850265 0.356318 0.655625 Pd\n0.356319 0.655622 0.850267 Pd\n",
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{
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"created_at": "2022-09-04T14:37:12.066370Z",
"updated_at": "2022-09-04T14:37:12.066395Z",
"structure_string": "Al3 Sn1\n1.0\n4.317526 0.000000 0.000000\n0.000000 4.317526 0.000000\n0.000000 0.000000 4.317526\nAl Sn\n3 1\ndirect\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Sn\n",
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"density_atomic": 0.049699853282204796,
"volume": 80.4831349760184,
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"formula_full": "Al3 Sn1",
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{
"id": "jvasp-100146",
"created_at": "2022-09-04T14:36:34.610276Z",
"updated_at": "2022-09-04T14:36:34.610302Z",
"structure_string": "Al3 Sn1\n1.0\n3.999229 0.156440 -3.595368\n-0.692709 3.941884 -3.595368\n-0.126216 -0.156440 5.376296\nAl Sn\n3 1\ndirect\n0.750000 0.250000 0.499999 Al\n0.249999 0.749999 0.499999 Al\n0.500000 0.499999 -0.000001 Al\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
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"elements": [
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"density": 4.094007377066592,
"density_atomic": 0.04939467811831785,
"volume": 80.98038396805775,
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},
{
"id": "jvasp-40439",
"created_at": "2022-09-04T14:38:02.887083Z",
"updated_at": "2022-09-04T14:38:02.887095Z",
"structure_string": "Al3 Tc1\n1.0\n-1.921476 1.921476 4.027520\n1.921476 -1.921476 4.027520\n1.921476 1.921476 -4.027520\nAl Tc\n3 1\ndirect\n0.750001 0.250000 0.500000 Al\n0.250000 0.750001 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 4,
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"elements": [
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"density": 4.995743216636289,
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"volume": 59.479543364860845,
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{
"id": "jvasp-92300",
"created_at": "2022-09-04T14:35:58.562018Z",
"updated_at": "2022-09-04T14:35:58.562043Z",
"structure_string": "Al3 Tc2\n1.0\n-2.178132 -3.772053 -0.000184\n-2.177629 3.771762 -0.000000\n-0.000347 -0.000200 -5.115284\nAl Tc\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.333267 0.666633 0.610055 Al\n0.666733 0.333367 0.389944 Al\n0.333381 0.666690 0.106224 Tc\n0.666619 0.333311 0.893774 Tc\n",
"nsites": 5,
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{
"id": "jvasp-79126",
"created_at": "2022-09-04T14:37:16.450234Z",
"updated_at": "2022-09-04T14:37:16.450254Z",
"structure_string": "Al3 Tl1\n1.0\n4.389260 -0.000000 -0.000000\n-0.000000 4.389260 -0.000000\n-0.000000 -0.000000 4.389260\nAl Tl\n3 1\ndirect\n0.000000 0.500002 0.500002 Al\n0.500002 0.000000 0.500002 Al\n0.500002 0.500002 0.000000 Al\n0.000000 0.000000 0.000000 Tl\n",
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{
"id": "jvasp-14955",
"created_at": "2022-09-04T14:36:50.076174Z",
"updated_at": "2022-09-04T14:36:50.076189Z",
"structure_string": "Al3 V1\n1.0\n3.489903 -0.000000 -1.442952\n-0.596610 3.438529 -1.442952\n0.004078 0.004847 4.951653\nAl V\n3 1\ndirect\n0.500000 0.500000 0.000000 Al\n0.250000 0.750001 0.500000 Al\n0.750000 0.250001 0.500000 Al\n0.000000 0.000000 0.000000 V\n",
"nsites": 4,
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},
{
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"created_at": "2022-09-04T14:37:28.161242Z",
"updated_at": "2022-09-04T14:37:28.161280Z",
"structure_string": "Al3 V1\n1.0\n3.910468 -0.000000 0.000000\n-0.000000 3.910468 0.000000\n-0.000000 -0.000000 3.910468\nAl V\n3 1\ndirect\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 V\n",
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{
"id": "jvasp-79127",
"created_at": "2022-09-04T14:36:35.416006Z",
"updated_at": "2022-09-04T14:36:35.416031Z",
"structure_string": "Al3 Zn1\n1.0\n4.047150 -0.000000 0.000000\n-0.000000 4.047150 0.000000\n-0.000000 0.000000 4.047150\nAl Zn\n3 1\ndirect\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.000000 Zn\n",
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{
"id": "jvasp-10875",
"created_at": "2022-09-04T14:37:11.388346Z",
"updated_at": "2022-09-04T14:37:11.388364Z",
"structure_string": "Al4 Ag4 O8\n1.0\n5.433318 0.000000 0.000000\n0.000000 5.481462 0.000000\n0.000000 0.000000 6.986104\nAl Ag O\n4 4 8\ndirect\n0.933203 0.000179 0.124299 Al\n0.566797 0.500178 0.624299 Al\n0.066797 0.500178 0.875700 Al\n0.433203 0.000179 0.375701 Al\n0.446813 0.997053 0.861697 Ag\n0.553187 0.497053 0.138302 Ag\n0.053187 0.497053 0.361697 Ag\n0.946813 0.997053 0.638302 Ag\n0.382203 0.564490 0.828846 O\n0.617797 0.064491 0.171153 O\n0.117797 0.064491 0.328847 O\n0.882203 0.564490 0.671153 O\n0.468021 0.686178 0.431616 O\n0.968021 0.686178 0.068384 O\n0.031979 0.186178 0.931616 O\n0.531980 0.186178 0.568383 O\n",
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{
"id": "jvasp-20159",
"created_at": "2022-09-04T14:37:53.955801Z",
"updated_at": "2022-09-04T14:37:53.955811Z",
"structure_string": "Al4 Au16\n1.0\n7.037880 0.000000 -0.000000\n-0.000000 7.037880 0.000000\n0.000000 -0.000000 7.037880\nAl Au\n4 16\ndirect\n0.064305 0.064305 0.064305 Al\n0.435695 0.935695 0.564305 Al\n0.564305 0.435695 0.935695 Al\n0.935695 0.564305 0.435695 Al\n0.283469 0.551638 0.611253 Au\n0.448362 0.111253 0.216531 Au\n0.611253 0.283469 0.551638 Au\n0.111253 0.216531 0.448362 Au\n0.051638 0.888747 0.716532 Au\n0.888747 0.716532 0.051638 Au\n0.551638 0.611253 0.283469 Au\n0.388747 0.783469 0.948362 Au\n0.216531 0.448362 0.111253 Au\n0.783469 0.948362 0.388747 Au\n0.317401 0.182599 0.817401 Au\n0.182599 0.817401 0.317401 Au\n0.817401 0.317401 0.182599 Au\n0.682599 0.682599 0.682599 Au\n0.948362 0.388747 0.783469 Au\n0.716532 0.051638 0.888747 Au\n",
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