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{
"id": "jvasp-87066",
"created_at": "2022-09-04T14:36:16.084937Z",
"updated_at": "2022-09-04T14:36:16.084955Z",
"structure_string": "Ba4 As4 Pt4\n1.0\n6.808391 -0.000000 0.000000\n0.000000 6.808391 0.000000\n-0.000000 0.000000 6.808391\nBa As Pt\n4 4 4\ndirect\n0.610919 0.389081 0.889081 Ba\n0.389081 0.889081 0.610919 Ba\n0.110919 0.110919 0.110919 Ba\n0.889081 0.610919 0.389081 Ba\n0.173144 0.326856 0.673144 As\n0.673144 0.173144 0.326856 As\n0.326856 0.673144 0.173144 As\n0.826856 0.826856 0.826856 As\n0.595148 0.904852 0.095148 Pt\n0.095148 0.595148 0.904852 Pt\n0.404852 0.404852 0.404852 Pt\n0.904852 0.095148 0.595148 Pt\n",
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{
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"updated_at": "2022-09-04T14:36:42.373281Z",
"structure_string": "Ba1 As2 Ru2\n1.0\n3.995822 -0.000000 -1.284075\n-0.412644 3.974458 -1.284075\n-0.002213 -0.002455 6.852302\nBa As Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.648442 0.648441 0.296881 As\n0.351559 0.351558 0.703118 As\n0.250001 0.750000 0.499999 Ru\n0.750000 0.250000 0.499999 Ru\n",
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"volume": 108.797770261382,
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"formula_full": "Ba1 As2 Ru2",
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{
"id": "jvasp-36505",
"created_at": "2022-09-04T14:37:30.914168Z",
"updated_at": "2022-09-04T14:37:30.914194Z",
"structure_string": "Ba3 Sb1 As1\n1.0\n6.434781 0.000000 0.000000\n0.000000 6.434781 -0.000000\n-0.000000 0.000000 6.434781\nBa Sb As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 As\n",
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"volume": 266.4411579400516,
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"formula_full": "Ba3 Sb1 As1",
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"spacegroup": 221
},
{
"id": "jvasp-36478",
"created_at": "2022-09-04T14:37:31.014637Z",
"updated_at": "2022-09-04T14:37:31.014653Z",
"structure_string": "Ba3 Sb1 As1\n1.0\n6.168213 -0.000000 0.000000\n0.000000 6.168213 0.000000\n-0.000000 -0.000000 6.168213\nBa Sb As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 As\n",
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"density": 4.306729819483881,
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"formula_full": "Ba3 Sb1 As1",
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{
"id": "jvasp-10865",
"created_at": "2022-09-04T14:38:35.096419Z",
"updated_at": "2022-09-04T14:38:35.096446Z",
"structure_string": "Ba6 Si4 As8\n1.0\n7.500567 0.010362 -2.004839\n-3.383355 7.380706 -2.626198\n0.001794 -0.001432 10.043044\nBa Si As\n6 4 8\ndirect\n0.939567 0.189566 0.379133 Ba\n0.183850 0.433851 0.867700 Ba\n0.816151 0.566150 0.132300 Ba\n0.306833 0.056833 0.113667 Ba\n0.693168 0.943168 0.886332 Ba\n0.060434 0.810434 0.620867 Ba\n0.624335 0.467498 0.638558 Si\n0.485777 0.828939 0.361441 Si\n0.375666 0.532503 0.361441 Si\n0.514224 0.171061 0.638558 Si\n0.915329 0.669075 0.858088 As\n0.244069 0.952458 0.395541 As\n0.084672 0.330925 0.141911 As\n0.755932 0.047543 0.604459 As\n0.348529 0.556917 0.604459 As\n0.651472 0.443084 0.395540 As\n0.442760 0.189013 0.858088 As\n0.557241 0.810988 0.141911 As\n",
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"density": 4.583798594825503,
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"volume": 556.3183607041422,
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{
"id": "jvasp-97335",
"created_at": "2022-09-04T14:36:10.609103Z",
"updated_at": "2022-09-04T14:36:10.609130Z",
"structure_string": "Ba12 Sn8 As16\n1.0\n8.041075 0.012683 0.000000\n-3.091185 7.513612 0.000000\n0.000000 0.000000 20.073030\nBa Sn As\n12 8 16\ndirect\n0.987464 0.740832 0.936158 Ba\n0.990733 0.788997 0.683034 Ba\n0.509266 0.211002 0.183034 Ba\n0.490733 0.788997 0.816966 Ba\n0.006086 0.262193 0.561103 Ba\n0.009267 0.211003 0.316966 Ba\n0.993914 0.737807 0.438897 Ba\n0.506085 0.262193 0.938897 Ba\n0.487465 0.740832 0.563842 Ba\n0.012535 0.259167 0.063842 Ba\n0.493914 0.737807 0.061103 Ba\n0.512535 0.259167 0.436158 Ba\n0.525105 0.209456 0.622810 Sn\n0.901770 0.316710 0.758187 Sn\n0.401771 0.316710 0.741813 Sn\n0.098229 0.683289 0.241813 Sn\n0.598229 0.683289 0.258187 Sn\n0.974895 0.790543 0.122810 Sn\n0.025105 0.209457 0.877190 Sn\n0.474895 0.790543 0.377190 Sn\n0.217067 0.515403 0.698352 As\n0.752018 0.499080 0.064257 As\n0.252018 0.499080 0.435743 As\n0.247982 0.500919 0.935743 As\n0.247334 -0.000458 0.553892 As\n0.252666 0.000458 0.053892 As\n0.752666 0.000458 0.446108 As\n0.747333 -0.000458 0.946108 As\n0.283902 0.967907 0.317330 As\n0.783901 0.967906 0.182670 As\n0.716098 0.032093 0.682670 As\n0.282933 0.484596 0.198352 As\n0.782933 0.484596 0.301648 As\n0.717067 0.515403 0.801648 As\n0.216098 0.032093 0.817330 As\n0.747982 0.500919 0.564257 As\n",
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"volume": 1213.549616733988,
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"formula_full": "Ba12 Sn8 As16",
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{
"id": "jvasp-56446",
"created_at": "2022-09-04T14:37:28.671458Z",
"updated_at": "2022-09-04T14:37:28.671479Z",
"structure_string": "Ba1 Zn2 As2\n1.0\n3.991188 0.000000 -1.158880\n-0.336492 3.976979 -1.158880\n-0.011189 -0.012176 7.413744\nBa Zn As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.635609 0.635608 0.271215 As\n0.364392 0.364391 0.728784 As\n",
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"spacegroup": 139
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{
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"created_at": "2022-09-04T14:36:04.172095Z",
"updated_at": "2022-09-04T14:36:04.172121Z",
"structure_string": "Ba3 Zn2 As4\n1.0\n0.000000 4.510935 -0.000000\n0.033209 -0.000000 7.269698\n7.810163 -2.255468 -3.309590\nBa Zn As\n3 2 4\ndirect\n0.855537 0.415206 0.711076 Ba\n0.144461 0.584795 0.288924 Ba\n0.000000 0.000000 0.000000 Ba\n0.669917 0.963701 0.339836 Zn\n0.330081 0.036299 0.660163 Zn\n0.793622 0.832216 0.587246 As\n0.206376 0.167784 0.412754 As\n0.509783 0.680948 0.019565 As\n0.490216 0.319053 0.980434 As\n",
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{
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"created_at": "2022-09-04T14:35:52.358025Z",
"updated_at": "2022-09-04T14:35:52.358042Z",
"structure_string": "Ba4 Zn8 As8\n1.0\n4.288795 0.000000 0.000000\n-0.000000 10.085852 0.000000\n0.000000 0.000000 11.010424\nBa Zn As\n4 8 8\ndirect\n0.750001 0.753203 0.174493 Ba\n0.750001 0.253203 0.325507 Ba\n0.250000 0.746797 0.674493 Ba\n0.250000 0.246797 0.825507 Ba\n0.250000 0.550693 0.381538 Zn\n0.750001 0.449307 0.618462 Zn\n0.750001 0.401011 0.050220 Zn\n0.750001 0.949307 0.881537 Zn\n0.750001 0.901011 0.449780 Zn\n0.250000 0.098989 0.550220 Zn\n0.250000 0.598989 0.949780 Zn\n0.250000 0.050693 0.118462 Zn\n0.750001 0.649520 0.461334 As\n0.250000 0.850480 0.961334 As\n0.750001 0.149520 0.038666 As\n0.750001 0.522011 0.839610 As\n0.250000 0.477989 0.160389 As\n0.750001 0.022011 0.660389 As\n0.250000 0.977989 0.339610 As\n0.250000 0.350480 0.538665 As\n",
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{
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"created_at": "2022-09-04T14:38:44.562073Z",
"updated_at": "2022-09-04T14:38:44.562098Z",
"structure_string": "Ba1 B2 As2\n1.0\n-2.094467 2.094467 5.335268\n2.094467 -2.094467 5.335268\n2.094467 2.094467 -5.335268\nBa B As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750002 0.250000 0.500002 B\n0.250000 0.750002 0.500002 B\n0.325757 0.325757 0.000000 As\n0.674242 0.674242 0.000000 As\n",
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{
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"created_at": "2022-09-04T14:36:51.300532Z",
"updated_at": "2022-09-04T14:36:51.300562Z",
"structure_string": "Ba3 B3 As3 O15\n1.0\n3.686674 -6.385508 0.000000\n3.686674 6.385508 -0.000000\n0.000000 -0.000000 7.179174\nBa B As O\n3 3 3 15\ndirect\n0.333337 0.058058 0.836240 Ba\n0.724721 0.666662 0.502907 Ba\n0.941941 0.275278 0.169574 Ba\n0.333270 0.569865 0.836271 B\n0.236594 0.666729 0.502939 B\n0.430134 0.763405 0.169605 B\n0.936519 0.269974 0.669559 As\n0.333456 0.063480 0.336226 As\n0.730024 0.666543 0.002893 As\n0.511513 0.521521 0.857445 O\n0.897597 0.080202 0.517885 O\n0.182606 0.102403 0.184552 O\n0.919796 0.817393 0.851219 O\n0.155104 0.343260 0.814861 O\n0.188155 0.844895 0.481528 O\n0.306490 0.666460 0.003041 O\n0.768549 0.515528 0.154694 O\n0.484471 0.253021 0.488028 O\n0.746978 0.231450 0.821361 O\n0.478478 0.989993 0.190778 O\n0.359969 0.693509 0.669708 O\n0.333539 0.640029 0.336374 O\n0.656739 0.811843 0.148194 O\n0.010006 0.488486 0.524112 O\n",
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}