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{
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{
"id": "jvasp-36718",
"created_at": "2022-09-04T14:37:53.256589Z",
"updated_at": "2022-09-04T14:37:53.256604Z",
"structure_string": "Na8 Zr4 O12\n1.0\n-5.346638 0.000000 1.811553\n-2.673319 4.895430 0.905776\n-5.334296 0.000000 -9.743276\nNa Zr O\n8 4 12\ndirect\n0.915158 0.669685 0.250000 Na\n0.084843 0.330315 0.750000 Na\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.841976 0.342341 0.499722 Na\n0.315683 0.342341 0.000278 Na\n0.158024 0.657659 0.500278 Na\n0.684318 0.657659 0.999722 Na\n0.750306 0.999388 0.750000 Zr\n0.249695 0.000612 0.250000 Zr\n0.582034 0.335933 0.250000 Zr\n0.417967 0.664067 0.750000 Zr\n0.048228 0.699023 0.857361 O\n0.679600 0.330578 0.855862 O\n0.489822 0.330578 0.644139 O\n0.320401 0.669422 0.144138 O\n0.510178 0.669422 0.355862 O\n0.879363 0.039603 0.355563 O\n0.581034 0.039603 0.144438 O\n0.120638 0.960397 0.644437 O\n0.418967 0.960397 0.855563 O\n0.951773 0.300977 0.142640 O\n0.247250 0.300977 0.357361 O\n0.752751 0.699023 0.642640 O\n",
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{
"id": "jvasp-121254",
"created_at": "2022-09-04T14:38:52.966279Z",
"updated_at": "2022-09-04T14:38:52.966300Z",
"structure_string": "Na2 P2\n1.0\n5.550861 0.335448 -0.782847\n0.153133 -3.364666 -0.348099\n2.204925 -1.090216 -4.937906\nNa P\n2 2\ndirect\n0.025654 0.052156 0.078352 Na\n0.432536 0.459053 0.264884 Na\n0.933589 0.755375 0.671562 P\n0.663093 0.255103 0.671810 P\n",
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{
"id": "jvasp-121255",
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"updated_at": "2022-09-04T14:38:52.994609Z",
"structure_string": "Na2 P1\n1.0\n4.368121 0.000000 0.000000\n0.000000 3.022740 0.000000\n0.000000 0.000000 7.061291\nNa P\n2 1\ndirect\n-0.033341 0.000000 0.767735 Na\n-0.033341 0.000000 0.232265 Na\n0.466683 0.000000 0.000000 P\n",
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"elements": [
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"formula_full": "Na2 P1",
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"spacegroup": 47
},
{
"id": "jvasp-97835",
"created_at": "2022-09-04T14:35:50.745873Z",
"updated_at": "2022-09-04T14:35:50.745888Z",
"structure_string": "Na4 P20\n1.0\n6.566077 -0.000000 0.000000\n0.000000 6.984877 0.000000\n0.000000 0.000000 11.032973\nNa P\n4 20\ndirect\n0.250000 0.091088 0.424917 Na\n0.750000 0.908913 0.575083 Na\n0.750000 0.591088 0.075083 Na\n0.250000 0.408913 0.924916 Na\n0.750000 0.435381 0.312061 P\n0.250000 0.564619 0.687939 P\n0.250000 0.024825 0.810225 P\n0.750000 0.975175 0.189775 P\n0.750000 0.524826 0.689775 P\n0.250000 0.475175 0.310225 P\n0.250000 0.869309 0.638412 P\n0.750000 0.130691 0.361588 P\n0.750000 0.369309 0.861588 P\n0.511796 0.595897 0.417561 P\n0.750000 0.064619 0.812061 P\n0.011796 0.404103 0.582439 P\n0.488205 0.095897 0.082439 P\n0.988205 0.904103 0.917561 P\n0.488205 0.404103 0.582439 P\n0.988205 0.595897 0.417561 P\n0.511796 0.904103 0.917561 P\n0.011796 0.095897 0.082439 P\n0.250000 0.630691 0.138412 P\n0.250000 0.935381 0.187939 P\n",
"nsites": 24,
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"elements": [
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"density": 2.3346759959291674,
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{
"id": "jvasp-121253",
"created_at": "2022-09-04T14:38:50.056714Z",
"updated_at": "2022-09-04T14:38:50.056742Z",
"structure_string": "Na1 P2\n1.0\n5.548530 0.000000 0.000000\n0.000000 5.183879 0.000000\n0.000000 0.000000 2.635566\nNa P\n1 2\ndirect\n0.000000 0.450665 0.000000 Na\n0.196787 0.950667 0.000000 P\n0.803213 0.950667 0.000000 P\n",
"nsites": 3,
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"density": 1.8605477645922612,
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"formula_full": "Na1 P2",
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{
"id": "jvasp-121257",
"created_at": "2022-09-04T14:38:55.239206Z",
"updated_at": "2022-09-04T14:38:55.239233Z",
"structure_string": "Na3 P1\n1.0\n4.764663 1.307444 -0.952953\n1.459316 -5.264035 -0.351866\n1.501745 0.720601 -4.738854\nNa P\n3 1\ndirect\n0.051885 -0.063239 0.112284 Na\n0.386074 0.370540 0.445274 Na\n0.720377 0.804296 0.778280 Na\n0.386173 0.870547 0.445265 P\n",
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"density": 1.3843758942516238,
"density_atomic": 0.033366621682371214,
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"formula_full": "Na3 P1",
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"spacegroup": 164
},
{
"id": "jvasp-10122",
"created_at": "2022-09-04T14:37:54.958779Z",
"updated_at": "2022-09-04T14:37:54.958808Z",
"structure_string": "Na8 P8\n1.0\n5.645392 0.000000 0.000000\n0.000000 6.032217 0.000000\n0.000000 0.000000 10.082607\nNa P\n8 8\ndirect\n0.343751 0.825765 0.717532 Na\n0.843751 0.674236 0.282469 Na\n0.656248 0.325765 0.782469 Na\n0.156249 0.174236 0.217532 Na\n0.615839 0.113738 0.419015 Na\n0.115839 0.386262 0.580986 Na\n0.384160 0.613738 0.080986 Na\n0.884160 0.886263 0.919015 Na\n0.116327 0.945656 0.465228 P\n0.616327 0.554344 0.534772 P\n0.883672 0.445656 0.034772 P\n0.383673 0.054344 0.965228 P\n0.847358 0.823598 0.618452 P\n0.347358 0.676403 0.381548 P\n0.152641 0.323597 0.881548 P\n0.652641 0.176403 0.118452 P\n",
"nsites": 16,
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"elements": [
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"density": 2.0878319849510425,
"density_atomic": 0.046598944890066184,
"volume": 343.3554136847169,
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"formula_full": "Na8 P8",
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"spacegroup": 19
},
{
"id": "jvasp-2148",
"created_at": "2022-09-04T14:36:03.281498Z",
"updated_at": "2022-09-04T14:36:03.281523Z",
"structure_string": "Na6 P2\n1.0\n2.473338 -4.283949 0.000000\n2.473338 4.283949 0.000000\n0.000000 0.000000 8.808096\nNa P\n6 2\ndirect\n0.000000 0.000000 0.750000 Na\n0.000000 0.000000 0.250000 Na\n0.666667 0.333333 0.420165 Na\n0.333333 0.666667 0.920165 Na\n0.333333 0.666667 0.579835 Na\n0.666667 0.333333 0.079835 Na\n0.666667 0.333333 0.750000 P\n0.333333 0.666667 0.250000 P\n",
"nsites": 8,
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"formula_full": "Na6 P2",
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"spacegroup": 194
},
{
"id": "jvasp-17752",
"created_at": "2022-09-04T14:37:29.986202Z",
"updated_at": "2022-09-04T14:37:29.986222Z",
"structure_string": "Na1 Pb3\n1.0\n4.916735 0.000000 -0.000000\n-0.000000 4.916735 -0.000000\n0.000000 0.000000 4.916735\nNa Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.499999 0.499999 Pb\n0.499999 0.499999 0.000000 Pb\n0.499999 0.000000 0.499999 Pb\n",
"nsites": 4,
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"elements": [
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"density": 9.005381196854602,
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},
{
"id": "jvasp-23698",
"created_at": "2022-09-04T14:37:36.543687Z",
"updated_at": "2022-09-04T14:37:36.543726Z",
"structure_string": "Na30 Pb8\n1.0\n10.779961 0.000000 -3.811292\n-5.389981 9.335720 -3.811292\n-0.000000 -0.000000 11.433876\nNa Pb\n30 8\ndirect\n0.250000 0.625000 0.375000 Na\n0.886600 0.470052 0.161918 Na\n0.029948 0.916548 0.691865 Na\n0.338083 0.808135 0.724683 Na\n0.613400 0.775318 0.583452 Na\n0.775318 0.583452 0.613401 Na\n0.583452 0.613400 0.775318 Na\n0.386600 0.661917 0.970053 Na\n0.191865 0.416548 0.529948 Na\n0.308135 0.838083 0.224683 Na\n0.083452 0.275318 0.113400 Na\n0.275318 0.113400 0.083452 Na\n0.416548 0.529948 0.191865 Na\n0.224682 0.308135 0.838083 Na\n0.661917 0.970052 0.386600 Na\n0.970052 0.386600 0.661918 Na\n0.838083 0.224682 0.308135 Na\n0.375000 0.250000 0.625000 Na\n0.125000 0.750000 0.875000 Na\n0.875000 0.125000 0.750000 Na\n0.529947 0.191865 0.416549 Na\n0.750000 0.875000 0.125000 Na\n0.113400 0.083452 0.275318 Na\n0.625000 0.375000 0.250000 Na\n0.161917 0.886600 0.470053 Na\n0.470052 0.161917 0.886600 Na\n0.724682 0.338083 0.808136 Na\n0.808135 0.724682 0.338083 Na\n0.691865 0.029948 0.916549 Na\n0.916548 0.691865 0.029948 Na\n0.084269 0.500000 0.000000 Pb\n0.415731 0.415731 0.415731 Pb\n0.584269 0.500000 0.000000 Pb\n0.000000 0.584269 0.500000 Pb\n0.500000 -0.000000 0.584269 Pb\n0.000000 0.084269 0.500000 Pb\n0.500000 -0.000000 0.084269 Pb\n0.915731 0.915731 0.915732 Pb\n",
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},
{
"id": "jvasp-37675",
"created_at": "2022-09-04T14:37:56.340497Z",
"updated_at": "2022-09-04T14:37:56.340520Z",
"structure_string": "Na1 Pd2 Pb1\n1.0\n0.000000 3.345596 3.345596\n3.345596 -0.000000 3.345596\n3.345596 3.345596 0.000000\nNa Pd Pb\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Pd\n0.500001 0.500001 0.500001 Pd\n0.750001 0.750001 0.750001 Pb\n",
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"volume": 74.89459633300854,
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"formula_full": "Na1 Pd2 Pb1",
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},
{
"id": "jvasp-80951",
"created_at": "2022-09-04T14:36:48.953896Z",
"updated_at": "2022-09-04T14:36:48.953931Z",
"structure_string": "Na2 Tl1 Pb1\n1.0\n-12.756261 2.766344 -2.847409\n-9.027650 0.611613 0.822908\n-7.573806 4.723705 -1.695224\nNa Tl Pb\n2 1 1\ndirect\n0.750025 -0.000019 -0.000020 Na\n0.249976 0.000019 0.000019 Na\n0.000000 0.000000 0.000000 Tl\n0.500001 -0.000000 -0.000001 Pb\n",
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}
]
}