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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1222",
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{
"id": "jvasp-88461",
"created_at": "2022-09-04T14:36:19.058542Z",
"updated_at": "2022-09-04T14:36:19.058560Z",
"structure_string": "Rb4 C1 O4\n1.0\n5.330043 0.000068 -2.100396\n-0.827734 5.265478 -2.100480\n-0.491883 -0.575361 6.564547\nRb C O\n4 1 4\ndirect\n0.557058 0.153353 0.710438 Rb\n0.442934 0.442923 0.289565 Rb\n0.846625 0.846628 0.289554 Rb\n0.153363 0.557065 0.710441 Rb\n0.000005 0.000008 -0.000002 C\n0.937883 0.225764 0.163645 O\n0.774246 0.774249 0.836356 O\n0.225764 0.937890 0.163647 O\n0.062126 0.062124 0.836358 O\n",
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{
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"structure_string": "K8 Sm4 F20\n1.0\n6.611446 0.000000 0.000000\n0.000000 7.441556 0.000000\n0.000000 0.000000 10.786552\nK Sm F\n8 4 20\ndirect\n0.535093 0.252450 0.170974 K\n0.464908 0.752451 0.829026 K\n0.964908 0.252450 0.670974 K\n0.035093 0.752451 0.329026 K\n0.535094 0.760305 0.170974 K\n0.464906 0.260305 0.829026 K\n0.964907 0.760305 0.670974 K\n0.035094 0.260305 0.329026 K\n0.067334 0.006377 0.003854 Sm\n0.932666 0.506377 0.996146 Sm\n0.567335 0.506377 0.496146 Sm\n0.432666 0.006377 0.503854 Sm\n0.848929 0.221702 0.920609 F\n0.848932 0.791051 0.920606 F\n0.151068 0.291051 0.079395 F\n0.908919 0.506376 0.490107 F\n0.091081 0.006376 0.509892 F\n0.591082 0.506376 0.990107 F\n0.408919 0.006376 0.009892 F\n0.151071 0.721702 0.079391 F\n0.348929 0.721702 0.579391 F\n0.362524 0.506369 0.327792 F\n0.332849 0.006371 0.300600 F\n0.667151 0.506371 0.699400 F\n0.167151 0.006371 0.800600 F\n0.832849 0.506371 0.199400 F\n0.348932 0.291051 0.579394 F\n0.637477 0.006369 0.672208 F\n0.137477 0.506369 0.827792 F\n0.862524 0.006369 0.172208 F\n0.651072 0.221702 0.420609 F\n0.651069 0.791051 0.420606 F\n",
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{
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"updated_at": "2022-09-04T14:37:30.896021Z",
"structure_string": "Ti1 Cr2 S4\n1.0\n4.774756 0.013938 -0.005336\n-0.326470 4.917935 0.006706\n-0.305301 -0.528873 4.890258\nTi Cr S\n1 2 4\ndirect\n0.151025 0.092393 0.878185 Ti\n0.720391 0.278711 0.517308 Cr\n0.720198 0.731605 0.064312 Cr\n0.223710 0.235261 0.445295 S\n0.687210 0.226719 0.012444 S\n0.223556 0.659528 0.021020 S\n0.773914 0.775784 0.561437 S\n",
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"volume": 114.86296821499191,
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"formula_full": "Ti1 Cr2 S4",
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"spacegroup": 8
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{
"id": "jvasp-25844",
"created_at": "2022-09-04T14:38:29.999143Z",
"updated_at": "2022-09-04T14:38:29.999159Z",
"structure_string": "Rb2 Al2 Sb2 O7\n1.0\n2.867198 -4.966132 0.000000\n2.867198 4.966132 -0.000000\n0.000000 -0.000000 8.356913\nRb Al Sb O\n2 2 2 7\ndirect\n0.333333 0.666667 0.407889 Rb\n0.666667 0.333333 0.592111 Rb\n0.000000 0.000000 0.793075 Al\n0.000000 0.000000 0.206925 Al\n0.666667 0.333333 0.151468 Sb\n0.333333 0.666667 0.848532 Sb\n0.168039 0.336079 0.716736 O\n0.336079 0.168039 0.283264 O\n0.663922 0.831962 0.716736 O\n0.168039 0.831961 0.716736 O\n0.831962 0.663922 0.283264 O\n0.000000 0.000000 0.000000 O\n0.831961 0.168039 0.283264 O\n",
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],
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"density_atomic": 0.05462501028052623,
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"formula_full": "Rb2 Al2 Sb2 O7",
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{
"id": "jvasp-112740",
"created_at": "2022-09-04T14:38:43.703538Z",
"updated_at": "2022-09-04T14:38:43.703565Z",
"structure_string": "Na8 Fe4 O12\n1.0\n5.123719 0.005368 -0.834579\n0.411839 8.614832 2.520278\n0.004695 -0.018902 5.560718\nNa Fe O\n8 4 12\ndirect\n0.749967 0.250032 0.499944 Na\n0.249973 0.750032 0.499949 Na\n-0.000002 0.999986 0.000010 Na\n0.500000 0.499986 0.000014 Na\n0.235761 0.078603 0.500054 Na\n0.735764 0.578604 0.500062 Na\n0.264197 0.421455 0.500024 Na\n0.764197 0.921455 0.500022 Na\n0.000900 0.333619 0.999997 Fe\n0.499117 0.166360 -0.000009 Fe\n0.500901 0.833620 1.000000 Fe\n0.999120 0.666360 -0.000005 Fe\n0.588161 0.033769 0.802301 O\n0.654509 0.345504 0.801322 O\n0.154511 0.845502 0.801326 O\n0.845507 0.154484 0.198669 O\n0.345510 0.654483 0.198676 O\n0.344720 0.277165 0.197682 O\n0.844723 0.777165 0.197686 O\n0.911864 0.466217 0.197683 O\n0.411863 0.966216 0.197682 O\n0.155290 0.222807 0.802306 O\n0.655294 0.722807 0.802309 O\n0.088164 0.533771 0.802304 O\n",
"nsites": 24,
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],
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{
"id": "jvasp-87844",
"created_at": "2022-09-04T14:36:15.598439Z",
"updated_at": "2022-09-04T14:36:15.598466Z",
"structure_string": "Cd8 P16\n1.0\n5.345925 -0.000000 0.000000\n-0.000000 5.345925 -0.000000\n-0.000000 -0.000000 20.012140\nCd P\n8 16\ndirect\n0.151810 0.625207 0.047653 Cd\n0.125208 0.348189 0.797653 Cd\n0.651810 0.874791 0.702347 Cd\n0.348189 0.125208 0.202347 Cd\n0.848189 0.374792 0.547653 Cd\n0.625207 0.151810 0.952347 Cd\n0.374792 0.848189 0.452347 Cd\n0.874791 0.651810 0.297653 Cd\n0.714755 0.192317 0.434823 P\n0.285244 0.807682 0.934823 P\n0.192317 0.714755 0.565177 P\n0.692316 0.785244 0.184823 P\n0.021707 0.020771 0.374149 P\n0.214756 0.307683 0.315177 P\n0.807682 0.285244 0.065177 P\n0.979228 0.978292 0.125851 P\n0.521707 0.479228 0.375851 P\n0.478292 0.520771 0.875851 P\n0.479228 0.521707 0.624149 P\n0.520771 0.478292 0.124149 P\n0.020771 0.021707 0.625851 P\n0.978292 0.979228 0.874149 P\n0.785244 0.692316 0.815177 P\n0.307683 0.214756 0.684823 P\n",
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},
{
"id": "jvasp-42946",
"created_at": "2022-09-04T14:38:13.535934Z",
"updated_at": "2022-09-04T14:38:13.535960Z",
"structure_string": "Li4 Ti3 V3 Cr2 O16\n1.0\n5.830139 -0.000792 0.000540\n-2.914414 5.053909 0.002804\n-0.000963 -0.016588 9.521066\nLi Ti V Cr O\n4 3 3 2 16\ndirect\n0.669004 0.338023 0.893798 Li\n0.996468 0.992963 0.993911 Li\n-0.001945 -0.003875 0.498044 Li\n0.335061 0.670157 0.394016 Li\n0.340722 0.175861 0.215787 Ti\n0.835037 0.175783 0.215799 Ti\n0.166446 0.332904 0.717526 Ti\n0.650719 0.829839 0.709809 V\n0.179101 0.829837 0.709810 V\n0.830960 0.661887 0.208741 V\n0.669518 0.339053 0.487480 Cr\n0.334491 0.669004 0.984106 Cr\n0.164793 0.329619 0.100445 O\n0.163555 0.832284 0.103053 O\n0.328485 0.656985 0.596596 O\n0.479082 0.519627 0.840998 O\n0.040527 0.519630 0.841000 O\n0.835915 0.671847 0.604198 O\n0.962743 0.483419 0.340873 O\n0.521343 0.042718 0.340681 O\n0.832177 0.165901 0.601341 O\n-0.003481 -0.006938 0.809809 O\n0.001992 0.003993 0.313685 O\n0.661820 0.323647 0.099380 O\n0.482112 0.964242 0.841684 O\n0.333707 0.165900 0.601341 O\n0.520662 0.483431 0.340874 O\n0.668709 0.832264 0.103055 O\n",
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],
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"volume_molar": 6.033248521391972,
"formula_full": "Li4 Ti3 V3 Cr2 O16",
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{
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"created_at": "2022-09-04T14:37:44.378455Z",
"updated_at": "2022-09-04T14:37:44.378465Z",
"structure_string": "Na2 Ti2 As2 O1\n1.0\n4.066652 -0.000000 0.000000\n-0.000000 4.066652 0.000000\n-2.033327 -2.033327 7.624783\nNa Ti As O\n2 2 2 1\ndirect\n0.181412 0.181412 0.362824 Na\n0.818587 0.818587 0.637176 Na\n-0.000000 0.500000 -0.000000 Ti\n0.500000 -0.000000 -0.000000 Ti\n0.380729 0.380729 0.761460 As\n0.619269 0.619269 0.238539 As\n0.000000 0.000000 0.000000 O\n",
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],
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"formula_full": "Na2 Ti2 As2 O1",
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},
{
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"created_at": "2022-09-04T14:36:13.462079Z",
"updated_at": "2022-09-04T14:36:13.462096Z",
"structure_string": "Li3 Nb1 O4\n1.0\n5.875114 -0.000000 -0.000000\n5.875114 5.143382 0.038740\n2.937557 3.447215 2.437244\nLi Nb O\n3 1 4\ndirect\n0.250000 0.500000 -0.000000 Li\n0.749999 0.500000 -0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.000000 0.000000 Nb\n0.230827 0.000025 0.538296 O\n0.769172 -0.000023 0.461702 O\n0.499999 0.500001 0.499999 O\n-0.000001 0.500001 0.499999 O\n",
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{
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"updated_at": "2022-09-04T14:35:59.076953Z",
"structure_string": "Rb8 C2 O8\n1.0\n5.905399 0.000000 0.000000\n0.000000 6.978609 0.035298\n0.000000 0.243642 8.315061\nRb C O\n8 2 8\ndirect\n0.736176 0.129267 0.400247 Rb\n0.230353 0.458275 0.397210 Rb\n0.715805 0.006040 0.833373 Rb\n0.911656 0.414150 0.965873 Rb\n0.215805 -0.006040 0.166627 Rb\n0.411656 0.585850 0.034128 Rb\n0.730353 0.541725 0.602790 Rb\n0.236176 0.870733 0.599753 Rb\n0.768544 0.709576 0.264830 C\n0.268544 0.290424 0.735170 C\n0.266614 0.499324 0.731877 O\n0.051221 0.225813 0.683080 O\n0.766614 0.500676 0.268123 O\n0.812636 0.781390 0.101695 O\n0.440286 0.224952 0.631147 O\n0.940286 0.775047 0.368853 O\n0.312636 0.218610 0.898305 O\n0.551221 0.774187 0.316920 O\n",
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{
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"structure_string": "Ca1 I2\n1.0\n2.237539 -3.875531 0.000000\n2.237539 3.875531 0.000000\n-0.000000 0.000000 6.946718\nCa I\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666667 0.254921 I\n0.666667 0.333333 0.745079 I\n",
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{
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"created_at": "2022-09-04T14:37:15.646816Z",
"updated_at": "2022-09-04T14:37:15.646845Z",
"structure_string": "Mg2 V4 O8\n1.0\n2.909219 0.003793 0.004978\n1.444806 7.361639 -0.080396\n1.440116 1.459182 7.268615\nMg V O\n2 4 8\ndirect\n0.323947 0.206927 0.153664 Mg\n0.682367 0.825082 0.818773 Mg\n0.636296 0.565342 0.170515 V\n0.144906 0.202568 0.516128 V\n0.861402 0.829428 0.456308 V\n0.369999 0.466662 0.801917 V\n0.862395 0.615187 0.668600 O\n0.468814 0.751359 0.319486 O\n0.537491 0.280640 0.652950 O\n0.143907 0.416812 0.303833 O\n0.168983 0.688142 0.982440 O\n0.787455 0.097356 0.336225 O\n0.837327 0.343863 0.989992 O\n0.218872 0.934644 0.636214 O\n",
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"formula_full": "Mg2 V4 O8",
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"spacegroup": 12
}
]
}