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{
"id": "jvasp-59246",
"created_at": "2022-09-04T14:38:08.273295Z",
"updated_at": "2022-09-04T14:38:08.273321Z",
"structure_string": "Ta4 Ga4 O16\n1.0\n5.005125 0.000000 0.000000\n0.000000 5.626340 0.000000\n0.000000 0.000000 9.335288\nTa Ga O\n4 4 16\ndirect\n0.762257 0.583031 0.126955 Ta\n0.762257 0.083031 0.373045 Ta\n0.262257 0.916969 0.626956 Ta\n0.262257 0.416969 0.873045 Ta\n0.245526 0.433173 0.378939 Ga\n0.745526 0.566827 0.621061 Ga\n0.745526 0.066827 0.878939 Ga\n0.245526 0.933173 0.121061 Ga\n0.921890 0.362577 0.991441 O\n0.417245 0.140231 0.987276 O\n0.576630 0.353273 0.759419 O\n0.076448 0.123364 0.762409 O\n0.576630 0.853273 0.740581 O\n0.076448 0.623364 0.737591 O\n0.417245 0.640231 0.512724 O\n0.576448 0.376636 0.262409 O\n0.917245 0.359769 0.487276 O\n0.421891 0.137423 0.491441 O\n0.421891 0.637423 0.008560 O\n0.076631 0.146727 0.259419 O\n0.576448 0.876636 0.237591 O\n0.076631 0.646727 0.240581 O\n0.921890 0.862577 0.508560 O\n0.917245 0.859769 0.012724 O\n",
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{
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"formula_full": "V2 Fe2 O8",
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{
"id": "jvasp-71220",
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"updated_at": "2022-09-04T14:36:12.736626Z",
"structure_string": "Mn2 Be1 Ir1\n1.0\n2.786022 0.000000 -0.000000\n0.000000 2.786022 0.000000\n-0.000000 0.000000 5.644761\nMn Be Ir\n2 1 1\ndirect\n0.000000 0.000000 0.037490 Mn\n0.500000 0.500000 0.253640 Mn\n0.000000 0.000000 0.488836 Be\n0.500000 0.500000 0.720034 Ir\n",
"nsites": 4,
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{
"id": "jvasp-71943",
"created_at": "2022-09-04T14:36:13.715574Z",
"updated_at": "2022-09-04T14:36:13.715597Z",
"structure_string": "Li2 Mn1 Be1\n1.0\n-1.602402 1.602402 4.265774\n1.602402 -1.602402 4.265774\n1.602402 1.602402 -4.265774\nLi Mn Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.250000 0.749999 0.500000 Mn\n0.749999 0.250000 0.500000 Be\n",
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},
{
"id": "jvasp-18983",
"created_at": "2022-09-04T14:36:59.733803Z",
"updated_at": "2022-09-04T14:36:59.733828Z",
"structure_string": "Ti8 O16\n1.0\n5.171752 -0.000000 0.000000\n0.000000 5.495267 0.000000\n0.000000 0.000000 9.249601\nTi O\n8 16\ndirect\n0.139135 0.405012 0.371043 Ti\n0.639134 0.594988 0.128956 Ti\n0.360865 0.905012 0.628956 Ti\n0.860865 0.094988 0.871043 Ti\n0.860865 0.594988 0.628956 Ti\n0.360865 0.405012 0.871043 Ti\n0.639134 0.094988 0.371043 Ti\n0.139135 0.905012 0.128956 Ti\n0.684447 0.851093 0.510008 O\n0.184447 0.148907 0.989991 O\n0.184447 0.648908 0.510008 O\n0.684447 0.351093 0.989991 O\n0.315552 0.148907 0.489991 O\n0.815552 0.851093 0.010008 O\n0.464648 0.890851 0.230217 O\n0.535351 0.109150 0.769783 O\n0.035352 0.390850 0.769783 O\n0.535351 0.609150 0.730217 O\n0.315552 0.648908 0.010008 O\n0.035352 0.890851 0.730217 O\n0.964648 0.609150 0.230217 O\n0.464648 0.390850 0.269783 O\n0.964648 0.109150 0.269783 O\n0.815552 0.351093 0.489991 O\n",
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{
"id": "jvasp-49853",
"created_at": "2022-09-04T14:37:15.191593Z",
"updated_at": "2022-09-04T14:37:15.191621Z",
"structure_string": "Tm4 Ga4 O12\n1.0\n5.220241 0.000000 0.000000\n0.000000 5.558169 0.000000\n0.000000 0.000000 7.549633\nTm Ga O\n4 4 12\ndirect\n0.021245 0.072614 0.990932 Tm\n0.478755 0.572614 0.990932 Tm\n0.521245 0.427386 0.490932 Tm\n0.978755 0.927386 0.490932 Tm\n0.000000 0.499994 0.240929 Ga\n0.500000 0.999994 0.240929 Ga\n0.500000 0.000006 0.740929 Ga\n-0.000000 0.500006 0.740929 Ga\n0.809970 0.193058 0.301091 O\n0.690030 0.693058 0.301091 O\n0.690040 0.693082 0.680753 O\n0.619256 0.956824 0.990925 O\n0.380744 0.043176 0.490926 O\n0.190040 0.806918 0.180753 O\n0.309970 0.306942 0.801091 O\n0.190030 0.806942 0.801091 O\n0.809960 0.193082 0.680753 O\n0.119256 0.543176 0.490926 O\n0.309960 0.306918 0.180753 O\n0.880744 0.456824 0.990925 O\n",
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],
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"volume": 219.0524633271205,
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"formula_full": "Tm4 Ga4 O12",
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"spacegroup": 62
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{
"id": "jvasp-113447",
"created_at": "2022-09-04T14:38:45.882039Z",
"updated_at": "2022-09-04T14:38:45.882056Z",
"structure_string": "B2 O1\n1.0\n3.694485 0.000000 0.000000\n0.000000 2.701009 0.000000\n0.000000 0.000000 3.292642\nB O\n2 1\ndirect\n0.031581 0.000000 0.748301 B\n0.031581 0.000000 0.251699 B\n0.336838 0.000000 0.000000 O\n",
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"volume": 32.85673859232668,
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"spacegroup": 25
},
{
"id": "jvasp-46260",
"created_at": "2022-09-04T14:35:54.207730Z",
"updated_at": "2022-09-04T14:35:54.207749Z",
"structure_string": "Li2 Ni3 Bi1 O8\n1.0\n-2.929609 1.691410 4.784031\n0.000000 3.382820 -4.784031\n-3.234330 -1.867342 -4.908432\nLi Ni Bi O\n2 3 1 8\ndirect\n0.882841 0.117160 0.648522 Li\n0.117160 0.882840 0.351478 Li\n0.500000 0.500000 0.000000 Ni\n0.500000 -0.000000 0.000000 Ni\n0.000000 0.500000 -0.000000 Ni\n0.500000 0.500000 0.500000 Bi\n0.752918 0.719737 0.786097 O\n0.752918 0.247083 0.786097 O\n0.270238 0.729763 0.810714 O\n0.280263 0.247083 0.786097 O\n0.719737 0.752917 0.213903 O\n0.729763 0.270238 0.189286 O\n0.247083 0.752918 0.213903 O\n0.247083 0.280263 0.213903 O\n",
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{
"id": "jvasp-23296",
"created_at": "2022-09-04T14:37:49.608916Z",
"updated_at": "2022-09-04T14:37:49.608941Z",
"structure_string": "Ca12 Cr8 Si12 O48\n1.0\n9.843677 -0.000000 -3.480265\n-4.921838 8.524874 -3.480265\n0.000000 0.000000 10.440795\nCa Cr Si O\n12 8 12 48\ndirect\n0.375000 0.750000 0.124999 Ca\n0.125000 0.250000 0.375000 Ca\n0.375000 0.125000 0.250000 Ca\n0.125000 0.375000 0.750000 Ca\n0.875000 0.750000 0.624999 Ca\n0.750000 0.125000 0.375000 Ca\n0.250000 0.375000 0.125000 Ca\n0.625000 0.875000 0.749999 Ca\n0.875000 0.625000 0.249999 Ca\n0.250000 0.875000 0.625000 Ca\n0.625000 0.250000 0.875000 Ca\n0.750000 0.625000 0.875000 Ca\n0.500000 0.000000 -0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n-0.000000 0.500000 -0.000000 Cr\n-0.000000 -0.000000 0.500000 Cr\n-0.000000 0.500000 0.500000 Cr\n0.500000 -0.000000 0.500000 Cr\n0.500000 0.500000 -0.000001 Cr\n0.000000 0.000000 0.000000 Cr\n0.250000 0.125000 0.875000 Si\n0.750000 0.875000 0.124999 Si\n0.375000 0.250000 0.625000 Si\n0.625000 0.375000 0.250000 Si\n0.875000 0.125000 0.750000 Si\n0.125000 0.750000 0.875000 Si\n0.375000 0.625000 0.750000 Si\n0.125000 0.875000 0.249999 Si\n0.875000 0.250000 0.125000 Si\n0.625000 0.750000 0.374999 Si\n0.750000 0.375000 0.625000 Si\n0.250000 0.625000 0.375000 Si\n0.508534 0.394221 0.807390 O\n0.491466 0.385685 0.298854 O\n0.692610 0.086831 0.701146 O\n0.086831 0.701145 0.692610 O\n0.991466 0.798854 0.885685 O\n0.807390 0.508534 0.394221 O\n0.413169 0.105779 0.614315 O\n0.885685 0.991465 0.798854 O\n0.298854 0.491465 0.385685 O\n0.394221 0.086831 0.885686 O\n0.385685 0.586831 0.894221 O\n0.491465 0.605779 0.192610 O\n0.114314 0.008534 0.201146 O\n0.586831 0.894221 0.385685 O\n0.192610 0.491465 0.605779 O\n0.008534 0.201146 0.114314 O\n0.913169 0.298854 0.307389 O\n0.894221 0.008534 0.307390 O\n0.307389 0.913168 0.298854 O\n0.192610 0.201146 0.586831 O\n0.605779 0.192610 0.491465 O\n0.586831 0.192610 0.201146 O\n0.201146 0.114314 0.008534 O\n0.201146 0.586831 0.192610 O\n0.114314 0.605779 0.913169 O\n0.008534 0.307390 0.894221 O\n0.894221 0.385685 0.586831 O\n0.105779 0.991465 0.692610 O\n0.605779 0.913168 0.114314 O\n0.913169 0.114314 0.605779 O\n0.086831 0.885685 0.394221 O\n0.508534 0.614314 0.701145 O\n0.614314 0.701145 0.508534 O\n0.692610 0.105779 0.991466 O\n0.701146 0.692610 0.086831 O\n0.807390 0.798854 0.413168 O\n0.394221 0.807389 0.508534 O\n0.105779 0.614314 0.413168 O\n0.413168 0.807389 0.798854 O\n0.798854 0.413168 0.807390 O\n0.885686 0.394221 0.086831 O\n0.991466 0.692610 0.105778 O\n0.701146 0.508534 0.614314 O\n0.298854 0.307390 0.913169 O\n0.307389 0.894221 0.008534 O\n0.385686 0.298854 0.491465 O\n0.798854 0.885685 0.991465 O\n0.614314 0.413168 0.105779 O\n",
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"formula_full": "Ca12 Cr8 Si12 O48",
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{
"id": "jvasp-34903",
"created_at": "2022-09-04T14:37:07.196141Z",
"updated_at": "2022-09-04T14:37:07.196166Z",
"structure_string": "Li8 P4 O14\n1.0\n-5.190008 0.002372 -0.001450\n2.561606 6.626573 0.034622\n-0.004314 -2.047300 -8.287765\nLi P O\n8 4 14\ndirect\n0.252791 0.145080 0.012736 Li\n0.747208 0.854919 0.987264 Li\n0.605297 0.583303 0.241976 Li\n0.394702 0.416696 0.758023 Li\n0.975011 0.325211 0.211262 Li\n0.024987 0.674788 0.788737 Li\n0.949770 0.246190 0.552282 Li\n0.050229 0.753809 0.447718 Li\n0.782789 0.225005 0.848506 P\n0.217210 0.774994 0.151493 P\n0.430180 0.213826 0.371328 P\n0.569818 0.786174 0.628671 P\n0.319594 0.271756 0.532097 O\n0.731347 0.040726 0.682143 O\n0.268651 0.959273 0.317857 O\n0.340323 0.296980 0.237652 O\n0.659675 0.703019 0.762348 O\n0.680405 0.728243 0.467903 O\n0.484837 0.737418 0.121887 O\n0.259796 0.743125 0.620694 O\n0.119781 0.849201 0.015589 O\n0.008388 0.401980 0.795985 O\n0.991610 0.598020 0.204014 O\n0.880218 0.150798 0.984410 O\n0.740203 0.256874 0.379306 O\n0.515162 0.262581 0.878113 O\n",
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{
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"created_at": "2022-09-04T14:37:54.530749Z",
"updated_at": "2022-09-04T14:37:54.530767Z",
"structure_string": "Li1 Ag1 O2\n1.0\n2.351958 1.610346 0.831450\n2.843572 -1.572802 0.304173\n2.345403 1.614695 -4.460153\nLi Ag O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.500001 -0.000000 0.000000 Ag\n0.899253 0.929923 0.271571 O\n0.100747 0.070076 0.728429 O\n",
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{
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]
}