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{
"id": "jvasp-113030",
"created_at": "2022-09-04T14:38:43.631069Z",
"updated_at": "2022-09-04T14:38:43.631102Z",
"structure_string": "Cu4 Te4 Se4 I4\n1.0\n4.795132 0.000000 0.000000\n-0.000000 7.714241 3.677584\n0.000000 0.119312 12.845589\nCu Te Se I\n4 4 4 4\ndirect\n0.878796 0.795497 0.253810 Cu\n0.121203 0.204502 0.746190 Cu\n0.378796 0.204502 0.246190 Cu\n0.621203 0.795497 0.753810 Cu\n0.503756 0.713081 0.144658 Te\n0.496244 0.286918 0.855342 Te\n0.003756 0.286918 0.355342 Te\n0.996243 0.713081 0.644658 Te\n0.726645 0.426432 0.152432 Se\n0.273355 0.573567 0.847568 Se\n0.226645 0.573568 0.347568 Se\n0.773355 0.426432 0.652432 Se\n0.639947 0.904846 0.393862 I\n0.360052 0.095154 0.606138 I\n0.139948 0.095154 0.106138 I\n0.860052 0.904846 0.893862 I\n",
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{
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"structure_string": "Ag4 Hg4 S4 I4\n1.0\n4.639588 0.000000 0.000000\n0.000000 10.236913 -0.000000\n0.000000 0.000000 9.960732\nAg Hg S I\n4 4 4 4\ndirect\n0.000000 0.210652 0.416951 Ag\n0.000000 0.789347 0.916951 Ag\n0.000000 0.789347 0.583048 Ag\n0.000000 0.210652 0.083049 Ag\n0.500000 0.235914 0.750000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.764086 0.250000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.261834 0.507424 S\n0.500000 0.738165 0.492575 S\n0.500000 0.261834 0.992575 S\n0.500000 0.738165 0.007425 S\n0.000000 0.526183 0.750000 I\n0.000000 0.987537 0.250000 I\n0.000000 0.473817 0.250000 I\n0.000000 0.012463 0.750000 I\n",
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{
"id": "jvasp-40594",
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"updated_at": "2022-09-04T14:37:56.325336Z",
"structure_string": "Rb4 Ba4 Ta4 S16\n1.0\n7.042254 0.000000 0.000000\n0.000000 9.396972 0.000000\n0.000000 0.000000 12.512297\nRb Ba Ta S\n4 4 4 16\ndirect\n0.750000 0.636659 0.090488 Rb\n0.250000 0.863341 0.590489 Rb\n0.750000 0.136659 0.409512 Rb\n0.250000 0.363341 0.909512 Rb\n0.750000 0.978589 0.825485 Ba\n0.250000 0.521410 0.325485 Ba\n0.750000 0.478590 0.674515 Ba\n0.250000 0.021410 0.174515 Ba\n0.250000 0.268795 0.578803 Ta\n0.750000 0.231205 0.078803 Ta\n0.250000 0.768795 0.921197 Ta\n0.750000 0.731205 0.421197 Ta\n0.489700 0.318879 0.162179 S\n0.510300 0.181121 0.662179 S\n0.989699 0.181121 0.662179 S\n0.010300 0.318879 0.162179 S\n0.510300 0.681120 0.837821 S\n0.489700 0.818879 0.337821 S\n0.250000 0.011825 0.912711 S\n0.250000 0.693639 0.094638 S\n0.250000 0.511825 0.587290 S\n0.750000 0.988175 0.087290 S\n0.250000 0.193639 0.405362 S\n0.750000 0.306361 0.905362 S\n0.989699 0.681120 0.837821 S\n0.750000 0.806361 0.594638 S\n0.750000 0.488175 0.412711 S\n0.010300 0.818879 0.337821 S\n",
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{
"id": "jvasp-91945",
"created_at": "2022-09-04T14:36:04.824596Z",
"updated_at": "2022-09-04T14:36:04.824624Z",
"structure_string": "Zn3 Cr1 Te4\n1.0\n6.184761 0.000000 0.000000\n-0.000000 6.184761 0.000000\n-0.000000 -0.000000 6.184761\nZn Cr Te\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Cr\n0.749201 0.749201 0.250799 Te\n0.749201 0.250799 0.749201 Te\n0.250799 0.749201 0.749201 Te\n0.250799 0.250799 0.250799 Te\n",
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{
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"created_at": "2022-09-04T14:37:06.731501Z",
"updated_at": "2022-09-04T14:37:06.731521Z",
"structure_string": "Sr2 Hg1 Ge1\n1.0\n4.771843 -0.000000 2.755025\n1.590614 4.498937 2.755025\n-0.000000 -0.000000 5.510049\nSr Hg Ge\n2 1 1\ndirect\n0.749999 0.750001 0.749999 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Hg\n0.499999 0.500000 0.499999 Ge\n",
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{
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"updated_at": "2022-09-04T14:38:05.377903Z",
"structure_string": "Pa2 Bi6\n1.0\n3.348827 -5.800339 -0.000000\n3.348827 5.800339 0.000000\n-0.000000 -0.000000 6.090009\nPa Bi\n2 6\ndirect\n0.333333 0.666667 0.250000 Pa\n0.666667 0.333333 0.750000 Pa\n0.171904 0.828097 0.750000 Bi\n0.656195 0.828097 0.750000 Bi\n0.171904 0.343806 0.750000 Bi\n0.828097 0.171904 0.250000 Bi\n0.343806 0.171904 0.250000 Bi\n0.828097 0.656195 0.250000 Bi\n",
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"spacegroup": 194
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{
"id": "jvasp-67582",
"created_at": "2022-09-04T14:35:48.925979Z",
"updated_at": "2022-09-04T14:35:48.925994Z",
"structure_string": "K1 Be1 Pb2\n1.0\n3.810039 0.000000 0.000000\n-0.000000 3.810039 0.000000\n0.000000 -0.000000 8.149273\nK Be Pb\n1 1 2\ndirect\n0.500000 0.500000 0.744656 K\n0.000000 0.000000 0.369902 Be\n0.000000 0.000000 0.054537 Pb\n0.500000 0.500000 0.330905 Pb\n",
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{
"id": "jvasp-86862",
"created_at": "2022-09-04T14:35:55.281241Z",
"updated_at": "2022-09-04T14:35:55.281258Z",
"structure_string": "Pr6 Mn2 Bi10\n1.0\n9.710149 0.000000 0.000000\n-4.855075 8.409236 -0.000000\n-0.000000 -0.000000 6.519411\nPr Mn Bi\n6 2 10\ndirect\n0.619485 0.619485 0.750000 Pr\n0.380516 -0.000000 0.750000 Pr\n0.619484 -0.000000 0.250000 Pr\n0.000000 0.380516 0.750000 Pr\n0.380516 0.380516 0.250000 Pr\n0.000000 0.619485 0.250000 Pr\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.748131 0.748131 0.250000 Bi\n0.666667 0.333333 0.500000 Bi\n0.251870 0.251869 0.750000 Bi\n0.333334 0.666667 0.000000 Bi\n0.251869 -0.000000 0.250000 Bi\n0.000001 0.748131 0.750000 Bi\n0.000000 0.251869 0.250000 Bi\n0.748131 -0.000000 0.750000 Bi\n0.333334 0.666667 0.500000 Bi\n0.666667 0.333333 0.000000 Bi\n",
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"formula_full": "Pr6 Mn2 Bi10",
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{
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"created_at": "2022-09-04T14:35:41.052348Z",
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"structure_string": "Pr6 Mn2 Bi10\n1.0\n9.710150 0.000000 0.000000\n-4.855075 8.409237 0.000000\n0.000000 -0.000000 6.519412\nPr Mn Bi\n6 2 10\ndirect\n0.619484 0.619485 0.750000 Pr\n0.380516 -0.000000 0.750000 Pr\n0.619484 -0.000000 0.250000 Pr\n-0.000000 0.380516 0.750000 Pr\n0.380516 0.380516 0.250000 Pr\n-0.000000 0.619485 0.250000 Pr\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.748130 0.748131 0.250000 Bi\n0.666667 0.333333 0.500000 Bi\n0.251869 0.251869 0.750000 Bi\n0.333333 0.666667 0.000000 Bi\n0.251869 -0.000000 0.250000 Bi\n-0.000000 0.748131 0.750000 Bi\n-0.000000 0.251869 0.250000 Bi\n0.748131 -0.000000 0.750000 Bi\n0.333333 0.666667 0.500000 Bi\n0.666667 0.333333 0.000000 Bi\n",
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{
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"created_at": "2022-09-04T14:36:11.572612Z",
"updated_at": "2022-09-04T14:36:11.572640Z",
"structure_string": "K2 Ce2 Ge2 Se8\n1.0\n6.570765 0.000000 -2.134624\n0.000000 7.066268 0.000000\n-0.033853 0.000000 8.929054\nK Ce Ge Se\n2 2 2 8\ndirect\n0.248512 0.718208 0.938551 K\n0.751489 0.218208 0.061450 K\n0.732195 0.213034 0.555228 Ce\n0.267806 0.713035 0.444772 Ce\n0.716829 0.746383 0.315710 Ge\n0.283172 0.246383 0.684290 Ge\n0.917849 0.750958 0.144522 Se\n0.082152 0.250957 0.855478 Se\n0.492755 0.968883 0.719784 Se\n0.927575 0.805867 0.581424 Se\n0.072426 0.305867 0.418576 Se\n0.463459 0.991959 0.265963 Se\n0.536542 0.491959 0.734037 Se\n0.507246 0.468883 0.280216 Se\n",
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{
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"structure_string": "La2 Tl1 Ag1\n1.0\n4.772069 0.000000 2.755155\n1.590689 4.499150 2.755155\n0.000000 0.000000 5.510311\nLa Tl Ag\n2 1 1\ndirect\n0.750000 0.750000 0.749998 La\n0.250000 0.250000 0.249999 La\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.499999 Ag\n",
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{
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"created_at": "2022-09-04T14:38:33.951947Z",
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"structure_string": "K2 Ta2 Ag4 Se8\n1.0\n5.803792 0.000000 -1.750025\n0.000000 7.929144 -0.000000\n-0.059558 -0.000000 10.301356\nK Ta Ag Se\n2 2 4 8\ndirect\n0.822939 0.750000 0.363766 K\n0.459174 0.250000 0.636234 K\n0.296775 0.750000 0.767780 Ta\n0.528995 0.250000 0.232220 Ta\n0.356185 0.000000 -0.000000 Ag\n0.356185 0.500000 -0.000000 Ag\n0.790935 0.750000 0.757692 Ag\n0.033243 0.250000 0.242308 Ag\n0.638047 0.750000 0.973292 Se\n0.664755 0.250000 0.026707 Se\n0.065089 0.008016 0.755806 Se\n0.309284 0.508016 0.244194 Se\n0.844230 0.250000 0.441022 Se\n0.309284 0.991983 0.244194 Se\n0.065089 0.491984 0.755806 Se\n0.403207 0.750000 0.558978 Se\n",
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]
}