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{
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"results": [
{
"id": "mp-1038761",
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{
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{
"id": "mp-573763",
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"structure_string": "Cs8 Te4\n1.0\n5.916540 0.000000 0.000000\n0.000000 9.527045 0.000000\n0.000000 0.000000 11.621285\nCs Te\n8 4\ndirect\n0.750000 0.977106 0.174687 Cs\n0.250000 0.522894 0.674687 Cs\n0.750000 0.349629 0.926945 Cs\n0.250000 0.650371 0.073055 Cs\n0.250000 0.022894 0.825313 Cs\n0.250000 0.150371 0.426945 Cs\n0.750000 0.849629 0.573055 Cs\n0.750000 0.477106 0.325313 Cs\n0.250000 0.746593 0.388174 Te\n0.750000 0.753407 0.888174 Te\n0.250000 0.246593 0.111826 Te\n0.750000 0.253407 0.611826 Te\n",
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{
"id": "mp-1206461",
"created_at": "2022-09-04T14:43:17.196749Z",
"structure_string": "Sm2 Mn1 Sb3\n1.0\n9.242805 0.000000 0.000000\n0.000000 9.242805 0.000000\n0.000000 0.000000 40.179076\nSm Mn Sb\n2 1 3\ndirect\n0.500000 0.500000 0.242742 Sm\n0.500000 0.500000 0.757258 Sm\n0.500000 0.500000 0.500000 Mn\n0.500000 0.500000 0.690696 Sb\n0.500000 0.500000 0.309304 Sb\n0.500000 0.500000 0.000000 Sb\n",
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{
"id": "mp-981215",
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"structure_string": "Zn3 Co1\n1.0\n3.733772 0.000000 0.000000\n0.000000 3.733772 0.000000\n0.000000 0.000000 3.733772\nZn Co\n3 1\ndirect\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Co\n",
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"spacegroup": 221
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{
"id": "mp-31105",
"created_at": "2022-09-04T14:46:00.109574Z",
"structure_string": "Rb16 Bi16\n1.0\n7.659416 0.000000 0.000000\n0.000000 14.224700 0.000000\n0.000000 5.971619 13.920831\nRb Bi\n16 16\ndirect\n0.857745 0.449571 0.851849 Rb\n0.357745 0.050429 0.148151 Rb\n0.142255 0.550429 0.148151 Rb\n0.642255 0.949571 0.851849 Rb\n0.577227 0.309646 0.656566 Rb\n0.077227 0.190354 0.343434 Rb\n0.422773 0.690354 0.343434 Rb\n0.922773 0.809646 0.656566 Rb\n0.804817 0.464921 0.395762 Rb\n0.304817 0.035079 0.604238 Rb\n0.195183 0.535079 0.604238 Rb\n0.695183 0.964921 0.395762 Rb\n0.617084 0.354626 0.124822 Rb\n0.117084 0.145374 0.875178 Rb\n0.382916 0.645374 0.875178 Rb\n0.882916 0.854626 0.124822 Rb\n0.799080 0.119794 0.573135 Bi\n0.299080 0.380206 0.426865 Bi\n0.200920 0.880206 0.426865 Bi\n0.700920 0.619794 0.573135 Bi\n0.565832 0.230309 0.398286 Bi\n0.065832 0.269691 0.601714 Bi\n0.434168 0.769691 0.601714 Bi\n0.934168 0.730309 0.398286 Bi\n0.874124 0.137438 0.103316 Bi\n0.374124 0.362562 0.896684 Bi\n0.125876 0.862562 0.896684 Bi\n0.625876 0.637438 0.103316 Bi\n0.133212 0.313565 0.070647 Bi\n0.633212 0.186435 0.929353 Bi\n0.866788 0.686435 0.929353 Bi\n0.366788 0.813565 0.070647 Bi\n",
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"formula_full": "Rb16 Bi16",
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"spacegroup": 14
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{
"id": "mp-1021369",
"created_at": "2022-09-04T14:41:58.558012Z",
"structure_string": "Mg12 Ti2 Si2\n1.0\n5.012595 0.000000 0.000000\n0.000000 5.854267 0.000000\n0.000000 0.000000 10.940744\nMg Ti Si\n12 2 2\ndirect\n0.500000 0.249128 0.421140 Mg\n0.500000 0.750872 0.421140 Mg\n0.000000 0.753573 0.081873 Mg\n0.000000 0.246427 0.081873 Mg\n0.000000 0.000000 0.327699 Mg\n0.000000 0.500000 0.325111 Mg\n0.500000 0.749128 0.921140 Mg\n0.500000 0.250872 0.921140 Mg\n0.000000 0.253573 0.581873 Mg\n0.000000 0.746427 0.581873 Mg\n0.000000 0.500000 0.827699 Mg\n0.000000 0.000000 0.825111 Mg\n0.500000 0.000000 0.173456 Ti\n0.500000 0.500000 0.673456 Ti\n0.500000 0.500000 0.167702 Si\n0.500000 0.000000 0.667702 Si\n",
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"elements": [
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"formula_full": "Mg12 Ti2 Si2",
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{
"id": "mp-11760",
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"structure_string": "Er2 Cd4 Cu2\n1.0\n3.478125 -5.264740 0.000000\n3.478125 5.264740 0.000000\n0.000000 0.000000 4.627667\nEr Cd Cu\n2 4 2\ndirect\n0.140648 0.859352 0.750000 Er\n0.859352 0.140648 0.250000 Er\n0.386959 0.196361 0.250000 Cd\n0.613041 0.803639 0.750000 Cd\n0.803639 0.613041 0.250000 Cd\n0.196361 0.386959 0.750000 Cd\n0.320228 0.679772 0.250000 Cu\n0.679772 0.320228 0.750000 Cu\n",
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{
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{
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"structure_string": "Ag4 Hg4 S4 Br4\n1.0\n4.677544 0.000000 0.000000\n0.000000 9.804695 0.000000\n0.000000 0.000000 9.963082\nAg Hg S Br\n4 4 4 4\ndirect\n0.000000 0.209328 0.415212 Ag\n0.000000 0.790672 0.584788 Ag\n0.000000 0.209328 0.084788 Ag\n0.000000 0.790672 0.915212 Ag\n0.500000 0.229300 0.750000 Hg\n0.500000 0.770700 0.250000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.254252 0.991671 S\n0.500000 0.745748 0.008329 S\n0.500000 0.745748 0.491671 S\n0.500000 0.254252 0.508329 S\n0.000000 0.012433 0.750000 Br\n0.000000 0.535219 0.750000 Br\n0.000000 0.464781 0.250000 Br\n0.000000 0.987567 0.250000 Br\n",
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{
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{
"id": "mp-1185735",
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"structure_string": "Mg16 Zr1 Al12\n1.0\n5.254203 -7.564561 0.000000\n5.254203 7.564561 0.000000\n-5.636618 0.000000 7.284076\nMg Zr Al\n16 1 12\ndirect\n0.004934 0.004934 0.344661 Mg\n0.996885 0.996885 0.996885 Mg\n0.395123 0.395123 0.721389 Mg\n0.685176 0.685176 0.279978 Mg\n0.605857 0.310867 0.998625 Mg\n0.310867 0.998625 0.605857 Mg\n0.721389 0.395123 0.395123 Mg\n0.344661 0.004934 0.004934 Mg\n0.998625 0.605857 0.310867 Mg\n0.685176 0.279978 0.685176 Mg\n0.279978 0.685176 0.685176 Mg\n0.605857 0.998625 0.310867 Mg\n0.004934 0.344661 0.004934 Mg\n0.395123 0.721389 0.395123 Mg\n0.998625 0.310867 0.605857 Mg\n0.310867 0.605857 0.998625 Mg\n0.628847 0.628847 0.628847 Zr\n0.374293 0.374293 0.194014 Al\n0.190790 0.190790 0.825252 Al\n0.812115 0.634161 0.992545 Al\n0.992545 0.812115 0.634161 Al\n0.374293 0.194014 0.374293 Al\n0.992545 0.634161 0.812115 Al\n0.190790 0.825252 0.190790 Al\n0.825252 0.190790 0.190790 Al\n0.634161 0.992545 0.812115 Al\n0.194014 0.374293 0.374293 Al\n0.812115 0.992545 0.634161 Al\n0.634161 0.812115 0.992545 Al\n",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.366000Z",
"spacegroup": 160
}
]
}