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{
"id": "jvasp-105290",
"created_at": "2022-09-04T14:36:54.693935Z",
"updated_at": "2022-09-04T14:36:54.693962Z",
"structure_string": "Er3 Al3 Co1 Ge2\n1.0\n6.872366 -0.000000 0.000000\n-3.436183 5.951644 0.000000\n-0.000000 -0.000000 4.125111\nEr Al Co Ge\n3 3 1 2\ndirect\n0.598390 0.000000 -0.000000 Er\n0.000000 0.598389 -0.000000 Er\n0.401610 0.401610 -0.000000 Er\n0.227358 0.000000 0.500000 Al\n0.000000 0.227358 0.500000 Al\n0.772643 0.772642 0.500000 Al\n0.000000 0.000000 0.000000 Co\n0.333334 0.666666 0.500000 Ge\n0.666667 0.333333 0.500000 Ge\n",
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{
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"structure_string": "Ho3 Mn3 Ga2 Si1\n1.0\n6.832079 0.000000 0.000000\n-3.416039 5.916754 0.000000\n-0.000000 -0.000000 4.136141\nHo Mn Ga Si\n3 3 2 1\ndirect\n0.003125 0.425315 0.500000 Ho\n0.574685 0.577809 0.500000 Ho\n0.422190 0.996874 0.500000 Ho\n0.010757 0.778983 -0.000000 Mn\n0.221017 0.231774 -0.000000 Mn\n0.768225 0.989242 -0.000000 Mn\n0.000000 0.000000 0.500000 Ga\n0.666667 0.333333 -0.000000 Ga\n0.333333 0.666666 -0.000000 Si\n",
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{
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"created_at": "2022-09-04T14:35:58.522485Z",
"updated_at": "2022-09-04T14:35:58.522510Z",
"structure_string": "K2 H6 C4 O6\n1.0\n3.730971 0.012133 0.067720\n-0.240307 5.456405 -1.071359\n0.188542 -0.079984 9.698053\nK H C O\n2 6 4 6\ndirect\n0.880778 0.707030 0.874189 K\n0.119220 0.292971 0.125810 K\n0.016330 0.164739 0.602551 H\n0.983668 0.835262 0.397449 H\n0.158407 0.471605 0.584326 H\n0.841592 0.528396 0.415674 H\n0.439589 0.218073 0.518632 H\n0.560409 0.781928 0.481368 H\n0.754380 0.704999 0.397595 C\n0.245619 0.295002 0.602405 C\n0.495402 0.151262 0.797453 C\n0.504597 0.848739 0.202546 C\n0.662142 0.217272 0.911004 O\n0.408702 0.350146 0.738090 O\n0.591296 0.649855 0.261909 O\n0.404573 0.938740 0.735253 O\n0.595425 0.061261 0.264746 O\n0.337856 0.782730 0.088996 O\n",
"nsites": 18,
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},
{
"id": "jvasp-106804",
"created_at": "2022-09-04T14:36:58.011502Z",
"updated_at": "2022-09-04T14:36:58.011512Z",
"structure_string": "Ho3 Er3 Mn1 Bi2\n1.0\n4.197214 0.000000 0.000000\n-0.000000 7.116699 4.108176\n-0.000000 0.000685 8.217331\nHo Er Mn Bi\n3 3 1 2\ndirect\n0.000000 0.232188 0.767812 Ho\n0.000000 0.767791 0.000011 Ho\n-0.000000 -0.000010 0.232209 Ho\n0.500000 0.611121 0.388879 Er\n0.500000 0.388861 0.000006 Er\n0.500000 0.999995 0.611139 Er\n0.500000 -0.000000 0.000000 Mn\n0.000000 0.333331 0.333343 Bi\n0.000000 0.666657 0.666670 Bi\n",
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{
"id": "jvasp-104161",
"created_at": "2022-09-04T14:36:55.181669Z",
"updated_at": "2022-09-04T14:36:55.181688Z",
"structure_string": "H3 C3 S2 N1\n1.0\n4.814992 0.006752 0.590020\n0.298962 4.490295 2.479586\n-0.017988 0.010648 5.138572\nH C S N\n3 3 2 1\ndirect\n0.877742 0.600828 0.697556 H\n0.401816 0.731598 0.763585 H\n0.926063 0.797373 0.891467 H\n0.901953 0.573139 0.921012 C\n0.638694 0.457023 0.118089 C\n0.165145 0.376593 0.037738 C\n0.624549 0.284095 0.483426 S\n0.179209 0.011208 0.210787 S\n0.401817 0.534009 0.961027 N\n",
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{
"id": "jvasp-107519",
"created_at": "2022-09-04T14:36:57.233289Z",
"updated_at": "2022-09-04T14:36:57.233317Z",
"structure_string": "Tb3 Mn3 Ga2 Ge1\n1.0\n6.946356 0.000000 0.000000\n-3.473178 6.015720 0.000000\n-0.000000 -0.000000 4.155404\nTb Mn Ga Ge\n3 3 2 1\ndirect\n0.246067 0.331842 0.500000 Tb\n0.085775 0.753933 0.500000 Tb\n0.668158 0.914225 0.500000 Tb\n0.888100 0.328250 -0.000000 Mn\n0.440151 0.111900 -0.000000 Mn\n0.671750 0.559849 -0.000000 Mn\n0.333333 0.666667 -0.000000 Ga\n0.666667 0.333333 0.500000 Ga\n0.000000 0.000000 0.000000 Ge\n",
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"formula_full": "Tb3 Mn3 Ga2 Ge1",
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{
"id": "jvasp-48548",
"created_at": "2022-09-04T14:37:02.696048Z",
"updated_at": "2022-09-04T14:37:02.696070Z",
"structure_string": "Li3 V1 O3 F2\n1.0\n-3.551133 0.072439 0.532298\n1.604404 4.840224 -1.377210\n0.946268 -1.172596 -5.119167\nLi V O F\n3 1 3 2\ndirect\n0.168167 0.779900 0.533755 Li\n0.666024 0.442957 0.903449 Li\n0.819317 0.249442 0.405506 Li\n-0.008923 0.009309 -0.030441 V\n0.054927 0.306785 0.805769 O\n0.530669 0.006039 0.054180 O\n0.758297 0.782408 0.718568 O\n0.247439 0.123743 0.380546 F\n0.910344 0.585683 0.234924 F\n",
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"density_atomic": 0.09913470508943119,
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{
"id": "jvasp-16753",
"created_at": "2022-09-04T14:38:28.460732Z",
"updated_at": "2022-09-04T14:38:28.460751Z",
"structure_string": "Er3 Al3 Ni1 Ge2\n1.0\n3.449717 -5.975085 -0.000000\n3.449717 5.975085 0.000000\n-0.000000 0.000000 4.132112\nEr Al Ni Ge\n3 3 1 2\ndirect\n0.597280 0.597280 0.500000 Er\n0.402720 0.000000 0.500000 Er\n0.000000 0.402720 0.500000 Er\n0.000001 0.770849 0.000000 Al\n0.229152 0.229152 0.000000 Al\n0.770849 0.000001 0.000000 Al\n0.000000 0.000000 0.500000 Ni\n0.333334 0.666667 0.000000 Ge\n0.666667 0.333334 0.000000 Ge\n",
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},
{
"id": "jvasp-109824",
"created_at": "2022-09-04T14:38:20.197384Z",
"updated_at": "2022-09-04T14:38:20.197398Z",
"structure_string": "Li3 V1 O3 F2\n1.0\n3.660295 -0.002281 -0.031646\n1.849956 4.071917 2.632490\n0.017658 0.702204 6.447686\nLi V O F\n3 1 3 2\ndirect\n0.145023 0.705704 0.553394 Li\n0.677682 0.644027 0.914674 Li\n0.810663 0.368306 0.419070 Li\n0.013842 0.021146 0.969830 V\n0.065042 0.863631 0.795252 O\n0.523426 0.944619 0.045659 O\n0.766122 0.468540 0.715935 O\n0.234657 0.520272 0.361813 F\n0.909817 0.171228 0.230627 F\n",
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{
"id": "jvasp-108937",
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"structure_string": "Ho3 Mn3 Ga2 Ge1\n1.0\n6.889747 0.000000 0.000000\n-3.444874 5.966696 0.000000\n-0.000000 -0.000000 4.113148\nHo Mn Ga Ge\n3 3 2 1\ndirect\n0.420755 0.419323 0.500000 Ho\n0.580677 0.001431 0.500000 Ho\n0.998569 0.579246 0.500000 Ho\n0.777927 0.773428 -0.000000 Mn\n0.226572 0.004498 -0.000000 Mn\n0.995502 0.222074 -0.000000 Mn\n0.333334 0.666667 -0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n0.666667 0.333334 -0.000000 Ge\n",
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{
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"created_at": "2022-09-04T14:38:28.468838Z",
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"structure_string": "Er3 Mn3 Ga2 Ge1\n1.0\n6.976110 -0.000000 0.000000\n-3.488055 6.041489 0.000000\n-0.000000 -0.000000 3.970082\nEr Mn Ga Ge\n3 3 2 1\ndirect\n0.000000 0.411705 0.500000 Er\n0.588296 0.588295 0.500000 Er\n0.411705 0.000000 0.500000 Er\n0.000001 0.773177 -0.000000 Mn\n0.226823 0.226823 -0.000000 Mn\n0.773177 0.000000 -0.000000 Mn\n0.333334 0.666667 -0.000000 Ga\n0.666667 0.333333 -0.000000 Ga\n0.000000 0.000000 0.500000 Ge\n",
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{
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"structure_string": "Li6 V2 O6 F4\n1.0\n5.297428 -0.091535 0.080437\n-2.206725 4.816792 -0.080437\n-1.024225 0.669926 7.863803\nLi V O F\n6 2 6 4\ndirect\n0.246530 0.428312 0.565387 Li\n0.427200 0.205370 0.928971 Li\n0.571689 0.753471 0.065388 Li\n0.794632 0.572800 0.428972 Li\n0.622028 0.029085 0.369662 Li\n0.970917 0.377973 0.869662 Li\n0.171083 0.175110 0.245767 V\n0.824891 0.828918 0.745766 V\n0.861439 0.876936 0.253790 O\n0.741955 0.579929 0.912836 O\n0.420073 0.258046 0.412836 O\n0.123064 0.138563 0.753790 O\n0.224115 0.404899 0.071173 O\n0.595102 0.775886 0.571172 O\n0.641777 0.018281 0.867103 F\n0.006230 0.621050 0.652031 F\n0.378952 0.993770 0.152031 F\n0.981721 0.358224 0.367103 F\n",
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}