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{
"id": "jvasp-56746",
"created_at": "2022-09-04T14:38:34.522328Z",
"updated_at": "2022-09-04T14:38:34.522354Z",
"structure_string": "Lu2 Al2 Si2\n1.0\n3.978179 0.000000 0.000000\n-1.989089 5.048517 0.000000\n0.000000 0.000000 5.626847\nLu Al Si\n2 2 2\ndirect\n0.306653 0.613305 0.750000 Lu\n0.693348 0.386695 0.250000 Lu\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.604446 0.208891 0.750000 Si\n0.395554 0.791110 0.250000 Si\n",
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{
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"structure_string": "Bi2 Te1 Se2\n1.0\n4.181373 -0.008043 9.303451\n1.988143 3.678482 9.303451\n-0.013519 -0.008043 10.199897\nBi Te Se\n2 1 2\ndirect\n0.594687 0.594689 0.594689 Bi\n0.405311 0.405312 0.405312 Bi\n0.000000 0.000000 0.000000 Te\n0.210223 0.210224 0.210224 Se\n0.789775 0.789777 0.789778 Se\n",
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{
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{
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"created_at": "2022-09-04T14:38:34.536122Z",
"updated_at": "2022-09-04T14:38:34.536146Z",
"structure_string": "Ga6 Te6\n1.0\n4.143298 -0.000000 0.000000\n-2.071649 8.513650 -2.171211\n0.000000 0.041204 10.575395\nGa Te\n6 6\ndirect\n0.136297 0.272595 0.417897 Ga\n0.863702 0.727405 0.582103 Ga\n0.239995 0.479990 0.299481 Ga\n0.760005 0.520010 0.700519 Ga\n0.563075 0.126152 0.081963 Ga\n0.436924 0.873848 0.918036 Ga\n0.156610 0.313220 0.049241 Te\n0.843390 0.686779 0.950759 Te\n0.158897 0.317794 0.677983 Te\n0.841103 0.682205 0.322017 Te\n0.538943 0.077887 0.327490 Te\n0.461057 0.922113 0.672509 Te\n",
"nsites": 12,
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"elements": [
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"chemical_system": "Ga-Te",
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"volume": 373.413382445524,
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"formula_full": "Ga6 Te6",
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{
"id": "jvasp-11396",
"created_at": "2022-09-04T14:38:34.536480Z",
"updated_at": "2022-09-04T14:38:34.536516Z",
"structure_string": "Sr4 Mg4 Si4\n1.0\n4.597113 0.000000 0.000000\n0.000000 7.802468 0.000000\n0.000000 0.000000 8.481038\nSr Mg Si\n4 4 4\ndirect\n0.250000 0.014401 0.184141 Sr\n0.250000 0.514401 0.315859 Sr\n0.749999 0.485599 0.684141 Sr\n0.749999 0.985599 0.815859 Sr\n0.749999 0.355198 0.065163 Mg\n0.250000 0.644802 0.934837 Mg\n0.749999 0.855198 0.434837 Mg\n0.250000 0.144802 0.565163 Mg\n0.749999 0.218843 0.391249 Si\n0.250000 0.281157 0.891249 Si\n0.250000 0.781158 0.608752 Si\n0.749999 0.718843 0.108752 Si\n",
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"formula_full": "Sr4 Mg4 Si4",
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{
"id": "jvasp-56600",
"created_at": "2022-09-04T14:38:34.537371Z",
"updated_at": "2022-09-04T14:38:34.537395Z",
"structure_string": "Dy16 Cd4 Rh4\n1.0\n8.260751 -0.000000 4.769347\n2.753584 7.788310 4.769347\n-0.000000 -0.000000 9.538694\nDy Cd Rh\n16 4 4\ndirect\n0.935886 0.564113 0.564114 Dy\n0.935886 0.564113 0.935887 Dy\n0.564113 0.935886 0.935887 Dy\n0.810735 0.189264 0.810736 Dy\n0.350152 0.350153 0.949541 Dy\n0.189264 0.810736 0.810736 Dy\n0.949541 0.350153 0.350153 Dy\n0.189264 0.810736 0.189265 Dy\n0.189264 0.189264 0.810735 Dy\n0.935886 0.935886 0.564114 Dy\n0.810735 0.189264 0.189265 Dy\n0.564113 0.935886 0.564114 Dy\n0.564113 0.564113 0.935887 Dy\n0.810735 0.810736 0.189265 Dy\n0.350152 0.350153 0.350153 Dy\n0.350152 0.949541 0.350153 Dy\n0.581777 0.254669 0.581777 Cd\n0.254669 0.581777 0.581778 Cd\n0.581777 0.581777 0.254670 Cd\n0.581777 0.581777 0.581778 Cd\n0.572332 0.142556 0.142557 Rh\n0.142556 0.142556 0.572332 Rh\n0.142556 0.572332 0.142557 Rh\n0.142556 0.142556 0.142556 Rh\n",
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{
"id": "jvasp-20859",
"created_at": "2022-09-04T14:38:34.539174Z",
"updated_at": "2022-09-04T14:38:34.539199Z",
"structure_string": "Ag2 Te8 Au2\n1.0\n0.000000 9.014416 0.054644\n4.502062 0.000000 0.000000\n0.000000 -5.753913 -8.551847\nAg Te Au\n2 8 2\ndirect\n0.500001 0.488826 0.750001 Ag\n0.500001 0.511173 0.250000 Ag\n0.808673 0.412507 0.546832 Te\n0.191328 0.412507 0.953169 Te\n0.299523 0.971914 0.297005 Te\n0.700478 0.971914 0.202996 Te\n0.700479 0.028085 0.702996 Te\n0.299523 0.028085 0.797005 Te\n0.808673 0.587492 0.046832 Te\n0.191328 0.587492 0.453169 Te\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
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{
"id": "jvasp-32820",
"created_at": "2022-09-04T14:38:34.541281Z",
"updated_at": "2022-09-04T14:38:34.541313Z",
"structure_string": "Sn4 I4 Cl4\n1.0\n4.404704 0.000000 0.000000\n0.000000 8.532576 0.000000\n0.000000 0.000000 10.186893\nSn I Cl\n4 4 4\ndirect\n0.749999 0.647439 0.851797 Sn\n0.250000 0.352561 0.148203 Sn\n0.749999 0.147439 0.648202 Sn\n0.250000 0.852562 0.351797 Sn\n0.749999 0.991876 0.169252 I\n0.250000 0.508124 0.669252 I\n0.749999 0.491876 0.330747 I\n0.250000 0.008124 0.830747 I\n0.250000 0.645798 0.053007 Cl\n0.749999 0.854203 0.553007 Cl\n0.250000 0.145797 0.446993 Cl\n0.749999 0.354203 0.946993 Cl\n",
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{
"id": "jvasp-118517",
"created_at": "2022-09-04T14:38:34.541993Z",
"updated_at": "2022-09-04T14:38:34.542015Z",
"structure_string": "Sr1 Sn1 H2\n1.0\n0.000000 3.253708 3.253708\n3.253708 0.000000 3.253708\n3.253708 3.253708 0.000000\nSr Sn H\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sn\n0.250000 0.250000 0.250000 H\n0.750000 0.750000 0.750000 H\n",
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{
"id": "jvasp-54927",
"created_at": "2022-09-04T14:38:34.546940Z",
"updated_at": "2022-09-04T14:38:34.546949Z",
"structure_string": "Pr3 Al4 Si6\n1.0\n2.112959 -3.659752 0.000000\n2.112959 3.659752 -0.000000\n-0.000000 0.000000 18.126949\nPr Al Si\n3 4 6\ndirect\n0.000000 0.000000 0.612298 Pr\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.387702 Pr\n0.333333 0.666667 0.754675 Al\n0.666667 0.333333 0.861079 Al\n0.333333 0.666667 0.138921 Al\n0.666667 0.333333 0.245325 Al\n0.333333 0.666667 0.896382 Si\n0.666667 0.333333 0.496351 Si\n0.333333 0.666667 0.503649 Si\n0.333333 0.666667 0.280185 Si\n0.666667 0.333333 0.103618 Si\n0.666667 0.333333 0.719816 Si\n",
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{
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"structure_string": "Li2 Mn2 P4 O16\n1.0\n0.000000 4.748515 0.049240\n8.412595 0.000000 0.000000\n0.000000 -4.397196 -6.321840\nLi Mn P O\n2 2 4 16\ndirect\n0.000000 0.500000 0.000000 Li\n-0.000000 0.000000 0.500000 Li\n0.499999 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.770141 0.172117 0.750518 P\n0.229857 0.672117 0.749482 P\n0.770141 0.327882 0.250518 P\n0.229857 0.827882 0.249482 P\n0.506567 0.626830 0.711011 O\n0.871916 0.878911 0.051297 O\n0.493431 0.126830 0.788989 O\n0.128082 0.378912 0.448703 O\n0.677322 0.398966 0.039747 O\n0.798607 0.144314 0.228874 O\n0.201391 0.855686 0.771126 O\n0.128082 0.121088 0.948703 O\n0.871916 0.621088 0.551297 O\n0.506568 0.873169 0.211011 O\n0.322676 0.898965 0.460253 O\n0.493431 0.373169 0.288989 O\n0.677322 0.101034 0.539747 O\n0.798607 0.355686 0.728874 O\n0.322676 0.601034 0.960253 O\n0.201391 0.644314 0.271126 O\n",
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],
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}