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"results": [
{
"id": "jvasp-116561",
"created_at": "2022-09-04T14:38:43.894452Z",
"updated_at": "2022-09-04T14:38:43.894474Z",
"structure_string": "Ce6 Mg23 Sn1\n1.0\n8.859053 0.000000 5.114777\n2.953018 8.352395 5.114777\n-0.000000 -0.000000 10.229553\nCe Mg Sn\n6 23 1\ndirect\n0.781293 0.781293 0.218707 Ce\n0.218707 0.781293 0.218707 Ce\n0.781293 0.218707 0.218707 Ce\n0.218707 0.218707 0.781293 Ce\n0.781293 0.218707 0.781293 Ce\n0.218707 0.781293 0.781293 Ce\n0.376939 0.869181 0.376939 Mg\n0.869181 0.376940 0.376940 Mg\n0.376939 0.376940 0.376939 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.376939 0.376940 0.869181 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.623060 0.623061 0.623061 Mg\n0.623060 0.623061 0.130820 Mg\n0.623060 0.130819 0.623061 Mg\n0.500000 0.500000 0.500000 Mg\n0.166481 0.166481 0.166481 Mg\n0.500555 0.166481 0.166482 Mg\n0.166481 0.500555 0.166481 Mg\n0.166481 0.166481 0.500555 Mg\n0.833518 0.833519 0.833519 Mg\n0.499445 0.833519 0.833519 Mg\n0.833518 0.499445 0.833519 Mg\n0.833518 0.833519 0.499445 Mg\n0.130819 0.623061 0.623060 Mg\n0.000000 0.000000 0.000000 Sn\n",
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{
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"structure_string": "Y2 Mg2\n1.0\n3.440310 0.000000 -0.000000\n-1.720155 2.979397 0.000000\n0.000000 -0.000000 11.012001\nY Mg\n2 2\ndirect\n0.666667 0.333333 0.868268 Y\n0.333332 0.666668 0.131732 Y\n0.333332 0.666668 0.615680 Mg\n0.666667 0.333333 0.384320 Mg\n",
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{
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"updated_at": "2022-09-04T14:38:28.603872Z",
"structure_string": "Li2 Sn2 P2 C2 O14\n1.0\n0.000000 5.002027 0.043131\n6.497842 0.000000 0.000000\n0.000000 -0.771247 -8.616011\nLi Sn P C O\n2 2 2 2 14\ndirect\n0.843434 0.250000 0.896406 Li\n0.156566 0.750000 0.103594 Li\n0.783095 0.750000 0.677963 Sn\n0.216905 0.250000 0.322037 Sn\n0.742513 0.250000 0.584816 P\n0.257487 0.750000 0.415184 P\n0.618689 0.750000 0.949538 C\n0.381311 0.250000 0.050462 C\n0.536740 0.250000 0.182917 O\n0.179962 0.933752 0.305027 O\n0.179962 0.566248 0.305027 O\n0.886283 0.250000 0.437700 O\n0.562510 0.750000 0.465476 O\n0.437490 0.250000 0.534524 O\n0.463260 0.750000 0.817083 O\n0.820038 0.433752 0.694973 O\n0.820038 0.066248 0.694973 O\n0.534153 0.750000 0.079416 O\n0.465847 0.250000 0.920584 O\n0.882471 0.750000 0.927222 O\n0.113717 0.750000 0.562300 O\n0.117529 0.250000 0.072778 O\n",
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"density_atomic": 0.07862064373614588,
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{
"id": "jvasp-96514",
"created_at": "2022-09-04T14:36:02.819547Z",
"updated_at": "2022-09-04T14:36:02.819575Z",
"structure_string": "Cd1 Hg1 C4 S4 N4\n1.0\n3.920907 0.000195 1.026084\n1.960836 8.190248 0.513003\n-0.111170 -0.000038 8.437556\nCd Hg C S N\n1 1 4 4 4\ndirect\n0.750066 0.499964 0.499935 Cd\n-0.000036 0.000009 0.000015 Hg\n0.117273 0.647466 0.828952 C\n0.235501 0.171047 0.647469 C\n0.593473 0.352534 0.171054 C\n0.053757 0.828965 0.352513 C\n0.165691 0.998397 0.284635 S\n0.449291 0.001787 0.715493 S\n0.835687 0.715417 0.998323 S\n0.549127 0.284605 0.001742 S\n0.975180 0.707087 0.403012 N\n0.317878 0.596891 0.707128 N\n0.085286 0.292798 0.596872 N\n0.621836 0.403035 0.292855 N\n",
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],
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{
"id": "jvasp-92908",
"created_at": "2022-09-04T14:36:06.574604Z",
"updated_at": "2022-09-04T14:36:06.574619Z",
"structure_string": "Mg6 Ga1 Mo1\n1.0\n6.127082 0.145930 0.000000\n-2.937162 5.087313 0.000000\n0.000000 0.000000 4.915442\nMg Ga Mo\n6 1 1\ndirect\n0.656673 0.327307 0.250000 Mg\n0.656673 0.829365 0.250000 Mg\n0.333293 0.177321 0.750000 Mg\n0.333293 0.655973 0.750000 Mg\n0.854880 0.177441 0.750000 Mg\n0.850918 0.675460 0.750000 Mg\n0.161284 0.830641 0.250000 Ga\n0.152984 0.326491 0.250000 Mo\n",
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"volume": 155.3230712296682,
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},
{
"id": "jvasp-11740",
"created_at": "2022-09-04T14:37:05.703504Z",
"updated_at": "2022-09-04T14:37:05.703543Z",
"structure_string": "Mg2 V4 O10\n1.0\n3.682639 -0.000000 0.000000\n-1.841319 5.045525 -0.000000\n-0.000000 0.000000 11.066877\nMg V O\n2 4 10\ndirect\n0.889416 0.778831 0.750000 Mg\n0.110585 0.221171 0.250000 Mg\n0.199187 0.398373 0.597521 V\n0.800815 0.601629 0.402478 V\n0.800815 0.601629 0.097522 V\n0.199187 0.398373 0.902480 V\n0.697751 0.395501 0.250000 O\n0.302251 0.604501 0.750000 O\n0.237588 0.475175 0.077074 O\n0.762414 0.524826 0.922926 O\n0.762414 0.524826 0.577074 O\n0.237588 0.475175 0.422925 O\n0.038790 0.077580 0.626594 O\n0.961210 0.922420 0.373406 O\n0.038790 0.077580 0.873407 O\n0.961210 0.922420 0.126595 O\n",
"nsites": 16,
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],
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"formula_full": "Mg2 V4 O10",
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},
{
"id": "jvasp-21373",
"created_at": "2022-09-04T14:37:47.672413Z",
"updated_at": "2022-09-04T14:37:47.672430Z",
"structure_string": "K2 Rb4 Sc2 F12\n1.0\n0.000000 6.375002 0.000970\n6.397818 0.000000 0.000000\n0.000000 -6.354327 -9.024374\nK Rb Sc F\n2 4 2 12\ndirect\n0.499999 0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.244126 0.468968 0.249768 Rb\n0.755873 0.968968 0.250232 Rb\n0.755872 0.531032 0.750231 Rb\n0.244126 0.031032 0.749768 Rb\n0.000000 0.000000 0.000000 Sc\n-0.000000 0.500000 0.500000 Sc\n0.286023 0.482581 0.720098 F\n0.713975 0.982581 0.779902 F\n0.222595 0.814468 0.967357 F\n0.777403 0.314468 0.532642 F\n0.777403 0.185532 0.032642 F\n0.144702 0.257173 0.963395 F\n0.855297 0.742828 0.036605 F\n0.144702 0.242828 0.463395 F\n0.286024 0.017419 0.220098 F\n0.855296 0.757173 0.536605 F\n0.222596 0.685533 0.467357 F\n0.713975 0.517420 0.279902 F\n",
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],
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"volume": 368.02960916134265,
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"formula_full": "K2 Rb4 Sc2 F12",
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{
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"created_at": "2022-09-04T14:35:49.525423Z",
"updated_at": "2022-09-04T14:35:49.525442Z",
"structure_string": "K2 Li1 Au1 Cl6\n1.0\n6.097345 -0.000000 3.520304\n2.032448 5.748632 3.520304\n0.000000 -0.000000 7.040608\nK Li Au Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Au\n0.749149 0.250851 0.250851 Cl\n0.250852 0.250851 0.749148 Cl\n0.250852 0.749148 0.749148 Cl\n0.250852 0.749148 0.250851 Cl\n0.749149 0.250851 0.749148 Cl\n0.749149 0.749148 0.250850 Cl\n",
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"density_atomic": 0.04052141087131224,
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"formula_full": "K2 Li1 Au1 Cl6",
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},
{
"id": "jvasp-9770",
"created_at": "2022-09-04T14:38:13.982476Z",
"updated_at": "2022-09-04T14:38:13.982496Z",
"structure_string": "Na2 Nb2 Cu4 S8\n1.0\n5.299724 -0.000000 -1.598049\n0.000000 7.480745 0.000000\n-0.068124 0.000000 9.361028\nNa Nb Cu S\n2 2 4 8\ndirect\n0.720755 0.750000 0.656860 Na\n0.063896 0.250000 0.343140 Na\n0.882723 0.750000 0.228779 Nb\n0.653944 0.250000 0.771221 Nb\n0.748715 0.000000 -0.000000 Cu\n0.748715 0.500000 -0.000000 Cu\n0.375051 0.750000 0.215593 Cu\n0.159459 0.250000 0.784408 Cu\n0.238224 0.750000 0.430314 S\n0.807910 0.250000 0.569687 S\n0.629046 0.001070 0.217915 S\n0.411132 -0.001070 0.782085 S\n0.001898 0.250000 0.991350 S\n0.010548 0.750000 0.008650 S\n0.411132 0.501070 0.782085 S\n0.629046 0.498930 0.217915 S\n",
"nsites": 16,
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{
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"created_at": "2022-09-04T14:36:17.710814Z",
"updated_at": "2022-09-04T14:36:17.710844Z",
"structure_string": "Li2 Fe1 F4\n1.0\n-0.000095 2.857216 2.857155\n4.451331 -2.857216 -0.000310\n0.000192 0.000000 -5.714309\nLi Fe F\n2 1 4\ndirect\n0.995855 0.499999 0.747929 Li\n0.996003 0.499999 0.248002 Li\n0.995808 -0.000001 0.997905 Fe\n0.521918 0.526013 0.760964 F\n0.469889 0.473985 0.234941 F\n0.495718 0.999996 0.497899 F\n0.495726 0.000002 0.997824 F\n",
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"spacegroup": 139
},
{
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"created_at": "2022-09-04T14:38:43.636876Z",
"updated_at": "2022-09-04T14:38:43.636902Z",
"structure_string": "Hf1 H6 C5 O4\n1.0\n3.622709 0.066865 -0.340052\n-0.533939 4.805114 -1.321658\n-0.418088 -0.385534 8.970439\nHf H C O\n1 6 5 4\ndirect\n0.273615 0.215276 0.267383 Hf\n0.828622 0.412906 0.977946 H\n0.244526 0.313157 0.907702 H\n0.896691 0.870135 0.701903 H\n0.477200 0.946584 0.760070 H\n0.556272 0.421225 0.703525 H\n-0.023281 0.336764 0.637140 H\n0.462890 0.849434 0.515246 C\n0.663129 0.991414 0.679099 C\n0.169250 0.731310 0.922422 C\n0.794585 0.303714 0.719455 C\n0.003354 0.430770 0.889780 C\n0.369041 -0.005073 0.420968 O\n0.380125 0.585553 0.469552 O\n0.172248 0.882474 0.065965 O\n0.766470 0.322667 0.224137 O\n",
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{
"id": "jvasp-46809",
"created_at": "2022-09-04T14:38:07.321188Z",
"updated_at": "2022-09-04T14:38:07.321215Z",
"structure_string": "Li2 Mn2 Si4 O12\n1.0\n6.591473 0.048008 -0.014331\n-0.691946 6.555230 0.014331\n-1.420654 1.269255 4.943292\nLi Mn Si O\n2 2 4 12\ndirect\n0.241550 0.241550 0.250000 Li\n0.758449 0.758451 0.750000 Li\n0.104632 0.104633 0.750000 Mn\n0.895367 0.895368 0.250000 Mn\n0.208730 0.610230 0.759066 Si\n0.389771 0.791270 0.259066 Si\n0.610229 0.208731 0.740934 Si\n0.791270 0.389771 0.240934 Si\n0.797793 0.029429 0.863979 O\n0.659759 0.370914 0.468450 O\n0.626242 0.887422 0.345181 O\n0.629087 0.340242 0.968450 O\n0.370913 0.659759 0.031550 O\n0.112578 0.373758 0.845181 O\n0.340241 0.629087 0.531549 O\n0.202206 0.970572 0.136021 O\n0.887421 0.626243 0.154818 O\n0.029428 0.797794 0.636021 O\n0.373757 0.112579 0.654818 O\n0.970572 0.202207 0.363979 O\n",
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],
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}
]
}