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"results": [
{
"id": "jvasp-26272",
"created_at": "2022-09-04T14:38:35.442552Z",
"updated_at": "2022-09-04T14:38:35.442571Z",
"structure_string": "Ti1 Al3\n1.0\n3.569839 0.000000 -1.454408\n-0.592549 3.520317 -1.454408\n0.001309 0.001547 5.111492\nTi Al\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 -0.000000 Al\n0.250000 0.750001 0.500000 Al\n0.750000 0.250001 0.500000 Al\n",
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{
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"structure_string": "Rb4 Pd2 N4 Cl4 O8\n1.0\n6.721273 0.000000 -3.444413\n-0.000000 7.641292 0.000000\n0.110478 -0.000000 8.495584\nRb Pd N Cl O\n4 2 4 4 8\ndirect\n0.862912 0.000000 0.725825 Rb\n0.637087 0.500000 0.274175 Rb\n0.362913 0.500000 0.725825 Rb\n0.137087 0.000000 0.274175 Rb\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.133974 0.500000 0.267949 N\n0.366026 0.000000 0.732051 N\n0.633974 0.000000 0.267949 N\n0.866025 0.500000 0.732051 N\n0.218697 0.718869 0.000000 Cl\n0.781302 0.281131 0.000000 Cl\n0.281302 0.218869 0.000000 Cl\n0.718697 0.781131 0.000000 Cl\n0.779635 0.097613 0.351137 O\n0.220365 0.902386 0.648863 O\n0.279635 0.402386 0.351136 O\n0.720365 0.597613 0.648863 O\n0.071502 0.597613 0.351136 O\n0.928498 0.402386 0.648863 O\n0.571501 0.902386 0.351137 O\n0.428498 0.097613 0.648863 O\n",
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{
"id": "jvasp-113167",
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"structure_string": "Na4 Fe4 O8\n1.0\n5.374169 -0.000000 0.000000\n0.000000 5.723116 0.000000\n-0.000000 -0.000000 7.190570\nNa Fe O\n4 4 8\ndirect\n0.019878 0.924303 0.621763 Na\n0.019878 0.424303 0.878237 Na\n0.519878 0.575698 0.121763 Na\n0.519878 0.075698 0.378237 Na\n0.507890 0.568651 0.626488 Fe\n0.507890 0.068650 0.873512 Fe\n0.007890 0.431350 0.373512 Fe\n0.007890 0.931350 0.126488 Fe\n0.089704 0.609194 0.158358 O\n0.157126 0.545668 0.593479 O\n0.657126 0.954333 0.093479 O\n0.589704 0.890807 0.658358 O\n0.657126 0.454333 0.406521 O\n0.589704 0.390807 0.841642 O\n0.089704 0.109194 0.341642 O\n0.157126 0.045668 0.906521 O\n",
"nsites": 16,
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"volume": 221.16030821221943,
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},
{
"id": "jvasp-98891",
"created_at": "2022-09-04T14:35:53.439341Z",
"updated_at": "2022-09-04T14:35:53.439369Z",
"structure_string": "P10 Br20 N10\n1.0\n8.605465 0.058442 -3.605376\n-1.505949 10.047604 -2.006667\n-0.024956 -0.021976 11.820495\nP Br N\n10 20 10\ndirect\n0.614556 0.314538 0.407573 P\n0.354143 0.521231 0.754698 P\n0.166769 0.706593 0.831932 P\n0.833230 0.293406 0.168067 P\n0.385443 0.685461 0.592426 P\n0.691167 0.040241 0.336665 P\n0.192837 0.995139 0.861049 P\n0.308832 0.959758 0.663334 P\n0.807162 0.004860 0.138950 P\n0.645856 0.478768 0.245301 P\n0.039417 0.947206 0.152940 Br\n0.537568 0.094952 0.745131 Br\n0.410780 0.520499 0.126676 Br\n0.973163 0.384760 0.079303 Br\n0.007709 0.330977 0.369953 Br\n0.635102 0.852997 0.978854 Br\n0.806939 0.008170 0.528428 Br\n0.364897 0.147002 0.021145 Br\n0.363048 0.278233 0.372385 Br\n0.262209 0.645692 0.384349 Br\n0.200824 0.328759 0.701679 Br\n0.193060 0.991829 0.471571 Br\n0.737790 0.354307 0.615650 Br\n0.462430 0.905047 0.254868 Br\n0.799175 0.671240 0.298320 Br\n0.636951 0.721766 0.627614 Br\n0.589219 0.479499 0.873324 Br\n0.960582 0.052793 0.847059 Br\n0.026835 0.615239 0.920696 Br\n0.992290 0.669022 0.630046 Br\n0.337965 0.810949 0.662367 N\n0.201469 0.011827 0.733499 N\n0.350731 0.549874 0.626998 N\n0.313186 0.630827 0.847240 N\n0.786200 0.141613 0.098211 N\n0.213798 0.858386 0.901789 N\n0.649267 0.450125 0.373001 N\n0.662033 0.189050 0.337632 N\n0.798530 0.988172 0.266500 N\n0.686813 0.369172 0.152759 N\n",
"nsites": 40,
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"elements": [
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],
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"volume": 1021.6912880401002,
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"formula_full": "P10 Br20 N10",
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{
"id": "jvasp-117847",
"created_at": "2022-09-04T14:38:53.722643Z",
"updated_at": "2022-09-04T14:38:53.722667Z",
"structure_string": "P1 Br3\n1.0\n6.647311 0.000000 0.000000\n-3.323656 5.756740 -0.000000\n0.000000 -0.000000 3.529070\nP Br\n1 3\ndirect\n0.000000 0.000000 0.000000 P\n0.350143 0.000000 0.000000 Br\n1.000000 0.350143 0.000000 Br\n0.649856 0.649857 0.000000 Br\n",
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"volume": 135.04636101302688,
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"spacegroup": 189
},
{
"id": "jvasp-24784",
"created_at": "2022-09-04T14:38:29.797300Z",
"updated_at": "2022-09-04T14:38:29.797328Z",
"structure_string": "Li6 Fe2 N4\n1.0\n4.245782 0.000000 -1.883504\n-0.871640 4.253569 -1.964846\n0.020990 0.001795 5.774476\nLi Fe N\n6 2 4\ndirect\n0.750000 0.500000 0.000000 Li\n0.250000 0.500000 -0.000000 Li\n0.492912 0.742913 0.485824 Li\n0.007088 0.257089 0.514176 Li\n0.992912 0.742913 0.485825 Li\n0.507088 0.257089 0.514177 Li\n0.750000 -0.000000 0.000000 Fe\n0.250000 -0.000000 0.000000 Fe\n0.885427 0.107707 0.770854 N\n0.614573 0.336853 0.229147 N\n0.114573 0.892294 0.229147 N\n0.385427 0.663149 0.770854 N\n",
"nsites": 12,
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{
"id": "jvasp-87170",
"created_at": "2022-09-04T14:35:45.470626Z",
"updated_at": "2022-09-04T14:35:45.470656Z",
"structure_string": "Li2 Mo2 P4 O14\n1.0\n4.909189 -0.024322 0.000000\n-2.366438 6.705366 0.000000\n0.000000 0.000000 8.407415\nLi Mo P O\n2 2 4 14\ndirect\n0.817035 0.833272 0.142844 Li\n0.182964 0.166729 0.642844 Li\n0.213796 0.226858 0.998338 Mo\n0.786203 0.773142 0.498338 Mo\n0.590914 0.966407 0.821150 P\n0.409088 0.033595 0.321150 P\n0.197593 0.576461 0.711951 P\n0.802407 0.423540 0.211951 P\n0.241062 0.012129 0.164376 O\n0.391043 0.091085 0.816987 O\n0.374232 0.583192 0.560810 O\n0.131023 0.374922 0.795297 O\n0.868979 0.625079 0.295297 O\n0.625769 0.416809 0.060810 O\n0.790907 0.006624 0.966351 O\n0.072239 0.370497 0.180698 O\n0.927761 0.629505 0.680699 O\n0.605443 0.264451 0.341101 O\n0.209092 0.993376 0.466351 O\n0.758938 0.987871 0.664376 O\n0.394559 0.735549 0.841101 O\n0.608956 0.908915 0.316986 O\n",
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"volume": 276.27062054016994,
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{
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"created_at": "2022-09-04T14:36:20.773327Z",
"updated_at": "2022-09-04T14:36:20.773346Z",
"structure_string": "Ti2 H4\n1.0\n0.000000 0.000000 3.051797\n4.038960 -0.000000 0.000000\n-0.000000 4.038960 0.000000\nTi H\n2 4\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 0.180614 0.819386 H\n0.500000 0.819386 0.180614 H\n0.000000 0.319386 0.319386 H\n0.000000 0.680614 0.680614 H\n",
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{
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"updated_at": "2022-09-04T14:37:34.703661Z",
"structure_string": "Cu1 H12 I4 N4\n1.0\n5.468622 4.376664 -4.382862\n-5.468622 4.376664 4.382862\n0.083170 0.000000 6.597839\nCu H I N\n1 12 4 4\ndirect\n0.500000 0.500000 0.000000 Cu\n0.719317 0.791365 0.145011 H\n0.208634 0.280682 0.145011 H\n0.791365 0.719317 0.854989 H\n0.555671 0.876198 0.851152 H\n0.123801 0.444328 0.851152 H\n0.280682 0.208634 0.854989 H\n0.876198 0.555671 0.148848 H\n0.495156 0.763626 0.104973 H\n0.236373 0.504843 0.104973 H\n0.504843 0.236373 0.895027 H\n0.763626 0.495156 0.895027 H\n0.444328 0.123801 0.148848 H\n0.907381 0.092618 0.535296 I\n0.092618 0.907381 0.464704 I\n0.699288 0.300711 0.619870 I\n0.300711 0.699288 0.380130 I\n0.238427 0.425304 0.027291 N\n0.761572 0.574695 0.972709 N\n0.425304 0.238427 0.972709 N\n0.574695 0.761572 0.027291 N\n",
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{
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"structure_string": "Na2 V8 O20\n1.0\n6.065909 0.004682 0.000000\n-4.980222 3.463044 0.000000\n-0.000000 -0.000000 18.354741\nNa V O\n2 8 20\ndirect\n0.930493 0.069506 0.250000 Na\n0.069506 0.930492 0.750000 Na\n0.435130 0.564869 0.584718 V\n0.272854 0.727144 0.086697 V\n0.272854 0.727144 0.413303 V\n0.435130 0.564869 0.915281 V\n0.727145 0.272854 0.913303 V\n0.727145 0.272854 0.586697 V\n0.564869 0.435129 0.084719 V\n0.564869 0.435129 0.415281 V\n0.297035 0.702964 0.173687 O\n0.101317 0.898682 0.069011 O\n0.459386 0.540613 0.672223 O\n0.418712 0.581286 0.049651 O\n0.459386 0.540613 0.827777 O\n0.101317 0.898682 0.430989 O\n0.297035 0.702964 0.326313 O\n0.418712 0.581286 0.450349 O\n0.581287 0.418712 0.950349 O\n0.702964 0.297035 0.826313 O\n0.898682 0.101317 0.930989 O\n0.581287 0.418712 0.549651 O\n0.702964 0.297035 0.673687 O\n0.259420 0.740579 0.564291 O\n0.740579 0.259420 0.435709 O\n0.540613 0.459386 0.172223 O\n0.898682 0.101317 0.569011 O\n0.740579 0.259420 0.064291 O\n0.540613 0.459386 0.327777 O\n0.259420 0.740579 0.935709 O\n",
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{
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"updated_at": "2022-09-04T14:36:59.617747Z",
"structure_string": "Ca3 Ge1 O1\n1.0\n4.706192 0.000000 -0.000000\n-0.000000 4.706192 -0.000000\n0.000000 0.000000 4.706192\nCa Ge O\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:37:56.161076Z",
"updated_at": "2022-09-04T14:37:56.161101Z",
"structure_string": "Tm1 Mg5\n1.0\n1.623426 -2.811855 0.000000\n1.623426 2.811855 -0.000000\n0.000000 -0.000000 15.877038\nTm Mg\n1 5\ndirect\n0.666668 0.333335 0.000000 Tm\n0.000000 0.000000 0.824491 Mg\n0.666668 0.333335 0.661853 Mg\n0.000000 0.000000 0.500000 Mg\n0.666668 0.333335 0.338147 Mg\n0.000000 0.000000 0.175509 Mg\n",
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}
]
}