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{
"id": "jvasp-119366",
"created_at": "2022-09-04T14:38:49.295295Z",
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{
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"structure_string": "Dy6 Co4 Si6\n1.0\n5.584686 0.010696 0.000000\n-4.095526 3.796774 0.000000\n0.000000 -0.000000 13.607941\nDy Co Si\n6 4 6\ndirect\n0.638524 0.361476 0.250000 Dy\n0.361476 0.638524 0.750000 Dy\n0.919486 0.080516 0.111697 Dy\n0.080514 0.919483 0.888303 Dy\n0.080514 0.919483 0.611697 Dy\n0.919486 0.080516 0.388303 Dy\n0.785879 0.214122 0.581919 Co\n0.214121 0.785878 0.418081 Co\n0.214121 0.785878 0.081919 Co\n0.785879 0.214122 0.918081 Co\n0.332350 0.667649 0.250000 Si\n0.667650 0.332351 0.750000 Si\n0.621680 0.378320 0.040266 Si\n0.378320 0.621680 0.959734 Si\n0.378320 0.621680 0.540266 Si\n0.621680 0.378320 0.459734 Si\n",
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{
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"structure_string": "Y2 Mg3 Zn3\n1.0\n4.675627 0.000385 7.061300\n2.126199 4.164225 7.061300\n0.000629 0.000385 8.468969\nY Mg Zn\n2 3 3\ndirect\n0.992903 0.992897 0.992901 Y\n0.506197 0.506194 0.506196 Y\n0.753482 0.753477 0.753481 Mg\n0.247579 0.247578 0.247579 Mg\n0.376536 0.376534 0.376536 Mg\n0.872759 0.872754 0.872757 Zn\n0.119897 0.119896 0.119897 Zn\n0.630659 0.630655 0.630658 Zn\n",
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{
"id": "jvasp-21681",
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"updated_at": "2022-09-04T14:37:27.420382Z",
"structure_string": "Sc6 Si6 Ni4\n1.0\n3.984150 0.000000 0.000000\n-1.992074 4.844958 0.000000\n0.000000 0.000000 13.147496\nSc Si Ni\n6 6 4\ndirect\n0.082852 0.165704 0.888309 Sc\n0.917149 0.834297 0.111691 Sc\n0.917149 0.834297 0.388309 Sc\n0.361139 0.722277 0.750000 Sc\n0.082852 0.165704 0.611692 Sc\n0.638862 0.277724 0.250000 Sc\n0.342086 0.684171 0.250000 Si\n0.657915 0.315830 0.750000 Si\n0.383073 0.766144 0.539093 Si\n0.616928 0.233856 0.460907 Si\n0.616928 0.233856 0.039093 Si\n0.383073 0.766144 0.960907 Si\n0.207782 0.415563 0.402731 Ni\n0.792219 0.584437 0.597270 Ni\n0.207782 0.415563 0.097270 Ni\n0.792219 0.584437 0.902731 Ni\n",
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{
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"structure_string": "Hf6 N4 O6\n1.0\n-3.996384 -0.008639 0.000440\n1.986560 5.297025 0.004545\n-0.001158 -0.112820 -10.619603\nHf N O\n6 4 6\ndirect\n0.816392 0.633413 0.751208 Hf\n0.855808 0.712236 0.059367 Hf\n0.863389 0.727446 0.444174 Hf\n0.191977 0.384568 0.250631 Hf\n0.143043 0.286681 0.944119 Hf\n0.137196 0.275011 0.559959 Hf\n0.700331 0.401267 0.920680 N\n0.953718 0.908246 0.615447 N\n0.296031 0.592723 0.425275 N\n0.299448 0.599513 0.080339 N\n0.689837 0.380301 0.580120 O\n0.751474 0.503575 0.248183 O\n0.954766 0.910095 0.887507 O\n0.246470 0.493559 0.742443 O\n0.044242 0.089121 0.115241 O\n0.042549 0.085575 0.379653 O\n",
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{
"id": "jvasp-21544",
"created_at": "2022-09-04T14:37:57.561665Z",
"updated_at": "2022-09-04T14:37:57.561685Z",
"structure_string": "Co8 Ge12 Se12\n1.0\n8.377420 -0.007234 0.010136\n0.010115 8.377416 0.010135\n-0.007249 -0.007234 8.377422\nCo Ge Se\n8 12 12\ndirect\n0.002961 0.002961 0.002961 Co\n0.502794 0.502795 0.502795 Co\n-0.000008 0.501426 0.501384 Co\n0.501384 -0.000008 0.501426 Co\n0.501426 0.501384 -0.000008 Co\n0.505764 0.004331 0.004373 Co\n0.004373 0.505765 0.004331 Co\n0.004331 0.004373 0.505764 Co\n0.753243 0.427086 0.910374 Ge\n0.910374 0.753245 0.427086 Ge\n0.427084 0.910375 0.753244 Ge\n0.578274 0.409895 0.250074 Ge\n0.250073 0.578275 0.409895 Ge\n0.409894 0.250074 0.578274 Ge\n0.595383 0.752514 0.078672 Ge\n0.078671 0.595384 0.752513 Ge\n0.927483 0.095860 0.255683 Ge\n0.095859 0.255683 0.927483 Ge\n0.255682 0.927483 0.095860 Ge\n0.752513 0.078672 0.595383 Ge\n0.401210 0.252449 0.908003 Se\n0.407437 0.604887 0.748968 Se\n0.604886 0.748969 0.407438 Se\n0.748968 0.407438 0.604887 Se\n0.597755 0.104544 0.253309 Se\n0.756787 0.098321 0.900871 Se\n0.104543 0.253309 0.597755 Se\n0.900870 0.756788 0.098321 Se\n0.098319 0.900872 0.756788 Se\n0.908003 0.401211 0.252449 Se\n0.253309 0.597756 0.104544 Se\n0.252448 0.908004 0.401211 Se\n",
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},
{
"id": "jvasp-21027",
"created_at": "2022-09-04T14:37:48.918760Z",
"updated_at": "2022-09-04T14:37:48.918781Z",
"structure_string": "Sc6 Fe4 Si6\n1.0\n3.948797 0.000000 -0.000000\n-1.974399 4.958320 -0.000000\n0.000000 0.000000 12.912271\nSc Fe Si\n6 4 6\ndirect\n0.360771 0.721541 0.750000 Sc\n0.080487 0.160975 0.612724 Sc\n0.080487 0.160975 0.887276 Sc\n0.919513 0.839025 0.112724 Sc\n0.639230 0.278458 0.250000 Sc\n0.919513 0.839025 0.387276 Sc\n0.214361 0.428723 0.082674 Fe\n0.785640 0.571277 0.582674 Fe\n0.214361 0.428723 0.417326 Fe\n0.785640 0.571277 0.917326 Fe\n0.330001 0.660003 0.250000 Si\n0.617280 0.234560 0.459077 Si\n0.617280 0.234560 0.040923 Si\n0.382720 0.765440 0.540923 Si\n0.669999 0.339997 0.750000 Si\n0.382720 0.765440 0.959077 Si\n",
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"formula_full": "Sc6 Fe4 Si6",
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{
"id": "jvasp-109666",
"created_at": "2022-09-04T14:37:56.649089Z",
"updated_at": "2022-09-04T14:37:56.649114Z",
"structure_string": "U2 Al3 Sn3\n1.0\n4.438091 0.000000 0.000000\n0.000000 4.474183 0.000000\n-0.000000 0.000000 8.936213\nU Al Sn\n2 3 3\ndirect\n0.000000 0.000000 0.753168 U\n0.000000 0.000000 0.246832 U\n0.500000 0.500000 0.764864 Al\n0.500000 0.500000 0.235135 Al\n0.500000 0.000000 -0.000000 Al\n0.500000 0.000000 0.500000 Sn\n-0.000000 0.500000 -0.000000 Sn\n-0.000000 0.500000 0.500000 Sn\n",
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{
"id": "jvasp-5740",
"created_at": "2022-09-04T14:37:52.058716Z",
"updated_at": "2022-09-04T14:37:52.058747Z",
"structure_string": "Na3 Li3 N2\n1.0\n0.000000 3.814957 -0.005262\n4.234847 0.000000 0.000000\n0.000000 -0.054895 -7.236994\nNa Li N\n3 3 2\ndirect\n0.334645 0.500000 0.477954 Na\n0.653736 0.000000 0.636130 Na\n0.592018 0.500000 0.142431 Na\n0.988082 0.000000 0.276280 Li\n0.452060 0.000000 0.974645 Li\n0.019776 0.500000 0.830733 Li\n0.484348 0.000000 0.285346 N\n0.517343 0.500000 0.815478 N\n",
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{
"id": "jvasp-45798",
"created_at": "2022-09-04T14:38:03.379815Z",
"updated_at": "2022-09-04T14:38:03.379836Z",
"structure_string": "Li3 Mn3 Fe2 O10\n1.0\n4.951991 -0.016887 0.021820\n0.789052 4.977116 -0.024929\n2.386367 1.997711 6.787453\nLi Mn Fe O\n3 3 2 10\ndirect\n0.221515 0.501213 0.572683 Li\n0.500000 -0.000000 0.500000 Li\n0.778486 0.498788 0.427316 Li\n-0.000000 0.500000 -0.000000 Mn\n0.686767 0.005775 0.108370 Mn\n0.313233 0.994225 0.891630 Mn\n0.105907 -0.000282 0.310571 Fe\n0.894094 0.000281 0.689429 Fe\n0.875212 0.775508 0.538226 O\n0.784481 0.237370 0.236871 O\n0.547388 0.211608 0.662677 O\n0.452612 0.788392 0.337322 O\n0.036078 0.778570 0.140442 O\n0.124789 0.224492 0.461773 O\n0.346080 0.213836 0.055877 O\n0.653921 0.786165 0.944122 O\n0.215519 0.762630 0.763128 O\n0.963922 0.221430 0.859557 O\n",
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{
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"structure_string": "K4 Ca6 Si6 O20\n1.0\n-4.581065 -5.301520 2.461599\n-4.581065 5.301520 2.461599\n0.028270 0.000000 -9.868922\nK Ca Si O\n4 6 6 20\ndirect\n0.230500 0.478869 0.988846 K\n0.521132 0.769501 0.511154 K\n0.769501 0.521132 0.011154 K\n0.478869 0.230500 0.488846 K\n0.368403 0.631598 0.750000 Ca\n0.631598 0.368403 0.250000 Ca\n0.227479 0.990639 0.985664 Ca\n0.009362 0.772522 0.514336 Ca\n0.772522 0.009362 0.014336 Ca\n0.990639 0.227479 0.485664 Ca\n0.840335 0.159666 0.750000 Si\n0.159666 0.840335 0.250000 Si\n0.853296 0.582287 0.710588 Si\n0.417714 0.146705 0.789412 Si\n0.146705 0.417714 0.289412 Si\n0.582287 0.853296 0.210588 Si\n0.026222 0.857029 0.090125 O\n0.142972 0.973779 0.409876 O\n0.699234 0.070035 0.277481 O\n0.929966 0.300767 0.222519 O\n0.300767 0.929966 0.722519 O\n0.070035 0.699234 0.777481 O\n0.785994 0.499391 0.520099 O\n0.500610 0.214007 0.979901 O\n0.214007 0.500610 0.479901 O\n0.309510 0.309631 0.728991 O\n0.612777 0.122149 0.737420 O\n0.877853 0.387224 0.762581 O\n0.387224 0.877853 0.262581 O\n0.122149 0.612777 0.237420 O\n0.690491 0.690370 0.271009 O\n0.309631 0.309510 0.228991 O\n0.857029 0.026222 0.590125 O\n0.690370 0.690491 0.771009 O\n0.499391 0.785994 0.020099 O\n0.973779 0.142972 0.909875 O\n",
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"formula_full": "K4 Ca6 Si6 O20",
"formula_reduced": "K2Ca3Si3O10",
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{
"id": "jvasp-48296",
"created_at": "2022-09-04T14:36:33.273065Z",
"updated_at": "2022-09-04T14:36:33.273094Z",
"structure_string": "Li3 V2 Fe3 O10\n1.0\n4.990983 -0.204105 0.041884\n0.880668 4.811852 0.258449\n2.190731 1.957123 6.973115\nLi V Fe O\n3 2 3 10\ndirect\n0.505414 0.784899 0.408064 Li\n0.000000 0.500000 0.500000 Li\n0.494586 0.215102 0.591935 Li\n-0.017140 0.839700 0.706833 V\n0.017140 0.160300 0.293166 V\n0.500000 0.000001 -0.000000 Fe\n0.990588 0.310689 0.893292 Fe\n0.009412 0.689311 0.106707 Fe\n0.233254 0.363442 0.043995 O\n0.773328 0.210927 0.753888 O\n0.769748 0.449936 0.342981 O\n0.230253 0.550064 0.657018 O\n0.206554 0.965572 0.859669 O\n0.766746 0.636558 0.956004 O\n0.774102 0.868974 0.543400 O\n0.225898 0.131027 0.456599 O\n0.226672 0.789074 0.246111 O\n0.793446 0.034429 0.140330 O\n",
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"volume": 165.70942969809468,
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"formula_full": "Li3 V2 Fe3 O10",
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}
]
}