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{
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{
"id": "jvasp-57290",
"created_at": "2022-09-04T14:37:54.455143Z",
"updated_at": "2022-09-04T14:37:54.455164Z",
"structure_string": "Na6 Pb1 O5\n1.0\n4.973307 -0.000000 2.530151\n2.486653 5.498360 1.265076\n-0.006518 -0.000000 6.165694\nNa Pb O\n6 1 5\ndirect\n0.795340 0.602858 0.000000 Na\n0.398198 0.000000 0.397142 Na\n0.795340 0.000000 0.602857 Na\n0.193690 0.500000 0.500000 Na\n0.398198 0.397142 0.000000 Na\n0.693690 0.500000 0.500000 Na\n0.038338 -0.000000 -0.000000 Pb\n0.207534 0.726164 0.726164 O\n0.422416 0.000000 -0.000000 O\n-0.066303 0.273836 0.726164 O\n0.659861 0.273836 0.273836 O\n-0.066303 0.726164 0.273837 O\n",
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{
"id": "jvasp-116367",
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"updated_at": "2022-09-04T14:38:31.033785Z",
"structure_string": "Na2 Pb2 O2\n1.0\n4.479357 -0.000000 0.000000\n0.000000 4.479357 0.000000\n0.000000 -0.000000 6.434145\nNa Pb O\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.500000 0.550771 Pb\n0.500000 0.000000 0.449228 Pb\n0.000000 0.500000 0.879839 O\n0.500000 0.000000 0.120160 O\n",
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},
{
"id": "jvasp-116363",
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"updated_at": "2022-09-04T14:38:30.971919Z",
"structure_string": "Na1 Pb1 O1\n1.0\n3.383674 1.558866 0.000000\n0.835991 6.964016 0.000000\n0.000000 0.000000 3.445941\nNa Pb O\n1 1 1\ndirect\n-0.017140 -0.112814 0.000000 Na\n-0.031018 0.405444 0.000000 Pb\n0.310102 0.062360 0.000000 O\n",
"nsites": 3,
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"volume": 76.709272220926,
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"formula_full": "Na1 Pb1 O1",
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"spacegroup": 25
},
{
"id": "jvasp-116366",
"created_at": "2022-09-04T14:38:41.831266Z",
"updated_at": "2022-09-04T14:38:41.831292Z",
"structure_string": "Na1 Pb1 O2\n1.0\n1.756893 1.014342 5.573849\n-1.756893 1.014342 5.573849\n0.000000 -2.028685 5.573849\nNa Pb O\n1 1 2\ndirect\n0.499999 0.499999 0.500001 Na\n0.000000 0.000000 0.000000 Pb\n0.255838 0.255838 0.255839 O\n0.744160 0.744160 0.744164 O\n",
"nsites": 4,
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"density": 7.305106269096087,
"density_atomic": 0.06711563109752045,
"volume": 59.59863499142122,
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"formula_full": "Na1 Pb1 O2",
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"formula_anonymous": "ABC2",
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"spacegroup": 166
},
{
"id": "jvasp-12289",
"created_at": "2022-09-04T14:37:50.278970Z",
"updated_at": "2022-09-04T14:37:50.278996Z",
"structure_string": "Na8 Pb2 O8\n1.0\n5.978480 0.003470 0.008175\n2.153398 5.572148 0.017970\n2.950094 0.099350 8.547336\nNa Pb O\n8 2 8\ndirect\n0.748949 0.750634 0.995072 Na\n0.251051 0.249366 0.004928 Na\n0.436500 0.254056 0.591435 Na\n0.563500 0.745944 0.408565 Na\n0.020176 0.264180 0.430724 Na\n0.979823 0.735820 0.569276 Na\n0.887345 0.277563 0.793607 Na\n0.112655 0.722437 0.206392 Na\n0.661067 0.274304 0.228420 Pb\n0.338932 0.725697 0.771580 Pb\n0.114266 0.509834 0.804177 O\n0.885734 0.490166 0.195823 O\n0.313845 0.486184 0.378334 O\n0.686155 0.513816 0.621665 O\n0.199054 0.992168 0.613586 O\n0.800946 0.007832 0.386413 O\n0.347874 0.842625 0.975360 O\n0.652126 0.157375 0.024640 O\n",
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"formula_full": "Na8 Pb2 O8",
"formula_reduced": "Na4PbO4",
"formula_anonymous": "AB4C4",
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"spacegroup": 2
},
{
"id": "jvasp-25620",
"created_at": "2022-09-04T14:37:47.591610Z",
"updated_at": "2022-09-04T14:37:47.591639Z",
"structure_string": "Na12 Pb2 O10\n1.0\n5.728944 -0.000000 0.000000\n-2.864472 5.361422 -0.000000\n0.000000 -0.000000 11.004671\nNa Pb O\n12 2 10\ndirect\n0.322522 0.000000 0.059919 Na\n0.781512 0.563027 0.500000 Na\n0.218487 0.436973 0.000000 Na\n0.167389 0.596099 0.250000 Na\n0.677477 0.000000 0.940082 Na\n0.218487 0.436973 0.500000 Na\n0.571289 0.403901 0.250000 Na\n0.781512 0.563027 0.000000 Na\n0.428710 0.596099 0.750000 Na\n0.677477 0.000000 0.559918 Na\n0.322522 0.000000 0.440082 Na\n0.832610 0.403901 0.750000 Na\n0.205995 0.000000 0.750000 Pb\n0.794005 0.000000 0.250000 Pb\n0.834791 0.280484 0.113261 O\n0.165208 0.719515 0.886739 O\n0.554306 0.719515 0.113261 O\n0.554306 0.719515 0.386739 O\n0.445693 0.280484 0.886739 O\n0.165208 0.719515 0.613261 O\n0.169878 0.000000 0.250000 O\n0.830121 0.000000 0.750000 O\n0.445693 0.280484 0.613261 O\n0.834791 0.280484 0.386739 O\n",
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"elements": [
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"density": 4.177100747829752,
"density_atomic": 0.07100347584078023,
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"formula_full": "Na12 Pb2 O10",
"formula_reduced": "Na6PbO5",
"formula_anonymous": "AB5C6",
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"spacegroup": 63
},
{
"id": "jvasp-88682",
"created_at": "2022-09-04T14:36:12.663097Z",
"updated_at": "2022-09-04T14:36:12.663128Z",
"structure_string": "Rb12 Na4 Pb4 O16\n1.0\n6.665532 0.000000 0.000000\n0.000000 10.246613 -4.115775\n0.000000 0.026834 11.172194\nRb Na Pb O\n12 4 4 16\ndirect\n0.620561 0.316966 0.892779 Rb\n0.679934 0.970254 0.330194 Rb\n0.179934 0.029745 0.169805 Rb\n0.879439 0.316966 0.392780 Rb\n0.887135 0.540765 0.185585 Rb\n0.112865 0.459234 0.814414 Rb\n0.820066 0.970254 0.830193 Rb\n0.612865 0.540765 0.685585 Rb\n0.120561 0.683033 0.607219 Rb\n0.379439 0.683033 0.107220 Rb\n0.320066 0.029745 0.669805 Rb\n0.387135 0.459234 0.314414 Rb\n0.619816 0.125378 0.109550 Na\n0.880184 0.125378 0.609549 Na\n0.119816 0.874622 0.390450 Na\n0.380184 0.874622 0.890449 Na\n0.853715 0.758947 0.009163 Pb\n0.146285 0.241052 0.990836 Pb\n0.353715 0.241052 0.490837 Pb\n0.646285 0.758947 0.509162 Pb\n0.991823 0.793857 0.188838 O\n0.617670 0.896823 0.049478 O\n0.075206 0.773823 0.880642 O\n0.508177 0.793857 0.688838 O\n0.424793 0.773823 0.380641 O\n0.882330 0.896822 0.549478 O\n0.382330 0.103177 0.950521 O\n0.735810 0.568535 0.942311 O\n0.924793 0.226176 0.119357 O\n0.575206 0.226176 0.619357 O\n0.008177 0.206142 0.811161 O\n0.117670 0.103177 0.450521 O\n0.235810 0.431465 0.557688 O\n0.264189 0.431465 0.057688 O\n0.764189 0.568535 0.442311 O\n0.491823 0.206142 0.311161 O\n",
"nsites": 36,
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"elements": [
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],
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"density": 4.788126414489898,
"density_atomic": 0.047133543780916276,
"volume": 763.787254515242,
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"formula_full": "Rb12 Na4 Pb4 O16",
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"formula_anonymous": "ABC3D4",
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},
{
"id": "jvasp-3822",
"created_at": "2022-09-04T14:36:22.359011Z",
"updated_at": "2022-09-04T14:36:22.359044Z",
"structure_string": "Na2 Pd3 O4\n1.0\n3.016134 -0.000000 -0.643451\n-0.440053 5.083774 -2.062722\n-0.016404 -0.013278 7.313798\nNa Pd O\n2 3 4\ndirect\n0.797659 0.297658 0.595319 Na\n0.202342 0.702340 0.404681 Na\n0.106751 0.106751 0.213503 Pd\n0.893249 0.893248 0.786497 Pd\n0.500000 0.500000 0.000000 Pd\n0.616081 0.869992 0.232161 O\n0.383920 0.130007 0.767840 O\n0.383920 0.637831 0.767840 O\n0.616081 0.362167 0.232161 O\n",
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"formula_full": "Na2 Pd3 O4",
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"formula_anonymous": "A2B3C4",
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},
{
"id": "jvasp-38676",
"created_at": "2022-09-04T14:37:52.596956Z",
"updated_at": "2022-09-04T14:37:52.596975Z",
"structure_string": "Na1 Pd1 O3\n1.0\n3.936688 0.000000 -0.000000\n-0.000000 3.936688 -0.000000\n-0.000000 0.000000 3.936688\nNa Pd O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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},
{
"id": "jvasp-50129",
"created_at": "2022-09-04T14:36:44.432353Z",
"updated_at": "2022-09-04T14:36:44.432371Z",
"structure_string": "Na1 Pd1 O2\n1.0\n2.962434 1.531468 -0.017488\n-2.962434 1.531468 0.017488\n-2.214095 0.000000 5.190053\nNa Pd O\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Pd\n0.283863 0.716138 0.787092 O\n0.716139 0.283862 0.212908 O\n",
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},
{
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"structure_string": "Na1 Pd1 O1\n1.0\n2.779656 0.000000 -0.000000\n0.000000 2.779656 -0.000000\n-0.000000 -0.000000 6.751346\nNa Pd O\n1 1 1\ndirect\n0.000000 0.000000 0.304127 Na\n0.000000 0.000000 0.722889 Pd\n0.000000 0.000000 -0.000543 O\n",
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},
{
"id": "jvasp-108867",
"created_at": "2022-09-04T14:38:26.913054Z",
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"structure_string": "Na2 Pd1 O6\n1.0\n5.918761 -0.281183 1.522579\n-3.029508 5.092433 1.522579\n0.293680 0.489042 3.883519\nNa Pd O\n2 1 6\ndirect\n0.669858 0.330142 0.500000 Na\n0.330142 0.669857 0.500001 Na\n-0.000000 -0.000000 0.500000 Pd\n0.782722 0.068008 0.225019 O\n0.068007 0.782722 0.225020 O\n0.400222 0.400222 -0.035622 O\n0.217277 0.931991 0.774982 O\n0.931992 0.217278 0.774981 O\n0.599777 0.599778 0.035622 O\n",
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"formula_full": "Na2 Pd1 O6",
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"formula_anonymous": "AB2C6",
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}
]
}