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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=323",
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"results": [
{
"id": "jvasp-50514",
"created_at": "2022-09-04T14:37:06.207946Z",
"updated_at": "2022-09-04T14:37:06.207963Z",
"structure_string": "Rb8 Sn2 O6\n1.0\n3.327176 9.650835 -0.147444\n-3.327176 9.650835 0.147444\n-2.598005 0.000000 6.475796\nRb Sn O\n8 2 6\ndirect\n0.597698 0.721870 0.808945 Rb\n0.457609 0.486858 0.721543 Rb\n0.037016 0.062904 0.741994 Rb\n0.347855 0.233119 0.880270 Rb\n0.278131 0.402302 0.308944 Rb\n0.513142 0.542391 0.221543 Rb\n0.937096 0.962985 0.241994 Rb\n0.766882 0.652145 0.380270 Rb\n0.875244 0.846894 0.722052 Sn\n0.153106 0.124756 0.222052 Sn\n0.165463 0.684899 0.947042 O\n0.033681 0.647635 0.542416 O\n0.315101 0.834537 0.447042 O\n0.352366 0.966319 0.042415 O\n0.708776 0.150796 0.528426 O\n0.849205 0.291224 0.028426 O\n",
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{
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"updated_at": "2022-09-04T14:37:06.591057Z",
"structure_string": "Ca2 Zn2 Si2 H4 O10\n1.0\n2.504434 7.979290 -0.592295\n-2.504434 7.979290 0.592295\n-0.002108 0.000000 5.454666\nCa Zn Si H O\n2 2 2 4 10\ndirect\n0.783907 0.072633 0.145122 Ca\n0.927366 0.216093 0.645123 Ca\n0.755936 0.743556 0.504837 Zn\n0.256445 0.244064 0.004836 Zn\n0.654287 0.620801 0.024226 Si\n0.379199 0.345713 0.524227 Si\n0.339936 0.686571 0.398705 H\n0.313429 0.660064 0.898706 H\n0.233813 0.934189 0.222720 H\n0.065811 0.766187 0.722720 H\n0.563091 0.347821 0.448299 O\n0.188568 0.896684 0.360282 O\n0.103316 0.811432 0.860282 O\n0.043961 0.669701 0.458182 O\n0.330299 0.956039 0.958182 O\n0.849519 0.565975 0.853505 O\n0.434025 0.150481 0.353505 O\n0.793255 0.523145 0.324126 O\n0.476855 0.206745 0.824126 O\n0.652179 0.436909 0.948300 O\n",
"nsites": 20,
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"formula_full": "Ca2 Zn2 Si2 H4 O10",
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{
"id": "jvasp-44414",
"created_at": "2022-09-04T14:37:07.817613Z",
"updated_at": "2022-09-04T14:37:07.817639Z",
"structure_string": "Li4 Mn6 W2 O16\n1.0\n5.818817 -0.025088 0.090496\n-2.931135 5.076875 -0.180993\n0.150630 -0.260898 9.672049\nLi Mn W O\n4 6 2 16\ndirect\n0.342088 0.656089 0.907028 Li\n0.019168 0.015594 0.989711 Li\n-0.019168 -0.003573 0.489711 Li\n0.657912 0.314001 0.407028 Li\n0.837036 0.659869 0.715508 Mn\n0.336648 0.166436 0.711015 Mn\n0.828063 0.169598 0.714806 Mn\n0.171937 0.341535 0.214806 Mn\n0.162964 0.822833 0.215508 Mn\n0.663352 0.829790 0.211015 Mn\n0.322442 0.646498 0.485337 W\n0.677558 0.324057 0.985337 W\n0.363542 0.211364 0.091838 O\n0.848958 0.683795 0.085418 O\n0.663701 0.325383 0.612193 O\n0.532523 0.025545 0.852382 O\n0.528331 0.477566 0.843910 O\n0.636458 0.847823 0.591839 O\n0.467477 0.493022 0.352382 O\n0.022541 0.500402 0.347526 O\n0.140782 0.346847 0.593882 O\n-0.001130 0.007508 0.803369 O\n0.001130 0.008638 0.303369 O\n0.336299 0.661683 0.112193 O\n0.977459 0.477860 0.847526 O\n0.151042 0.834837 0.585418 O\n0.471669 0.949236 0.343910 O\n0.859218 0.206066 0.093882 O\n",
"nsites": 28,
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"density_atomic": 0.09833511624938021,
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"formula_full": "Li4 Mn6 W2 O16",
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{
"id": "jvasp-49860",
"created_at": "2022-09-04T14:37:08.565879Z",
"updated_at": "2022-09-04T14:37:08.565891Z",
"structure_string": "Ba2 Be2 P2 O8 F2\n1.0\n4.896151 0.006448 -0.000967\n-0.003463 4.896649 -0.002405\n-2.410667 -2.412979 8.452581\nBa Be P O F\n2 2 2 8 2\ndirect\n0.003538 0.003057 0.000425 Ba\n0.752651 0.254037 0.500477 Ba\n0.167089 0.652714 0.336086 Be\n0.402346 0.417696 0.836080 Be\n0.582915 0.561341 0.165385 P\n0.310993 0.833538 0.665389 P\n0.838290 0.736319 0.298695 O\n0.604740 0.604636 0.005540 O\n0.996339 0.834312 0.659305 O\n0.303784 0.684219 0.196837 O\n0.354126 0.855218 0.505487 O\n0.583725 0.246680 0.159228 O\n0.434017 0.554537 0.696918 O\n0.486031 0.088976 0.798606 O\n0.175502 0.334650 0.347444 F\n0.084207 0.425989 0.847351 F\n",
"nsites": 16,
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"elements": [
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"density_atomic": 0.07896993131828582,
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{
"id": "jvasp-52605",
"created_at": "2022-09-04T14:37:08.924267Z",
"updated_at": "2022-09-04T14:37:08.924288Z",
"structure_string": "H8 O4\n1.0\n4.379160 0.000000 0.059872\n-2.189580 3.783386 -0.029936\n-0.023541 0.000000 7.113932\nH O\n8 4\ndirect\n0.294641 0.660475 0.671335 H\n0.430919 0.929939 0.951930 H\n0.430498 0.558325 0.954901 H\n0.414593 0.527203 0.486016 H\n0.634167 0.339526 0.171336 H\n0.500980 0.070062 0.451931 H\n0.872176 0.441676 0.454901 H\n0.887390 0.472798 -0.013984 H\n0.287156 0.653508 0.529788 O\n0.301427 0.678021 0.906025 O\n0.633650 0.346493 0.029788 O\n0.623409 0.321980 0.406026 O\n",
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"elements": [
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"formula_full": "H8 O4",
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},
{
"id": "jvasp-9938",
"created_at": "2022-09-04T14:37:09.324850Z",
"updated_at": "2022-09-04T14:37:09.324871Z",
"structure_string": "Ca4 Y2 Sb2 O10\n1.0\n6.056159 0.007799 0.013062\n-0.008608 5.943684 -0.000936\n-2.539400 -2.973951 7.446254\nCa Y Sb O\n4 2 2 10\ndirect\n0.787255 0.363215 0.745488 Ca\n0.619934 0.134154 0.227208 Ca\n0.119950 0.595897 0.227196 Ca\n0.287213 0.885061 0.745465 Ca\n0.682792 0.733512 0.476042 Y\n0.182794 0.245356 0.476040 Y\n0.478645 0.502478 -0.000339 Sb\n-0.021340 -0.000031 -0.000313 Sb\n0.609900 0.170277 0.910427 O\n0.791828 0.685065 0.039635 O\n0.414786 0.399371 0.369656 O\n0.884125 0.757719 0.745622 O\n0.351564 0.916060 0.481892 O\n0.384127 0.490763 0.745625 O\n0.851542 0.068677 0.481871 O\n0.109947 0.242995 0.910416 O\n0.914821 0.473170 0.369718 O\n0.291754 0.857393 0.039673 O\n",
"nsites": 18,
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"elements": [
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],
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"volume": 268.2157243896115,
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"formula_full": "Ca4 Y2 Sb2 O10",
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{
"id": "jvasp-57540",
"created_at": "2022-09-04T14:37:09.484769Z",
"updated_at": "2022-09-04T14:37:09.484793Z",
"structure_string": "K6 Na4 Li2 Te2 O12\n1.0\n6.806181 0.005823 -0.273505\n-0.379433 7.334741 -1.847574\n0.005438 -0.020394 7.573340\nK Na Li Te O\n6 4 2 2 12\ndirect\n0.776951 0.372254 0.404651 K\n0.435673 0.011082 0.109120 K\n0.244091 0.782725 0.701352 K\n0.276951 0.404650 0.372255 K\n0.935673 0.109120 0.011083 K\n0.744091 0.701351 0.782726 K\n0.895734 0.071319 0.613028 Na\n0.395734 0.613028 0.071320 Na\n0.592730 0.857733 0.431953 Na\n0.092730 0.431953 0.857734 Na\n0.246429 0.033629 0.471898 Li\n0.746429 0.471898 0.033629 Li\n0.497456 0.242989 0.758118 Te\n-0.002544 0.758117 0.242989 Te\n0.509725 0.324412 0.031941 O\n0.598984 0.005487 0.768304 O\n0.899805 0.744243 0.481827 O\n0.221360 0.141715 0.743146 O\n0.098984 0.768304 0.005488 O\n0.721359 0.743145 0.141715 O\n0.009725 0.031941 0.324413 O\n0.495972 0.161553 0.486501 O\n0.995972 0.486501 0.161554 O\n0.272893 0.769942 0.345882 O\n0.399805 0.481826 0.744244 O\n0.772893 0.345881 0.769943 O\n",
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"formula_full": "K6 Na4 Li2 Te2 O12",
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{
"id": "jvasp-56768",
"created_at": "2022-09-04T14:37:09.540655Z",
"updated_at": "2022-09-04T14:37:09.540663Z",
"structure_string": "Pr2 Co2 C4\n1.0\n3.789480 -0.001973 -0.558164\n-0.082643 3.788579 -0.558164\n-0.021398 -0.021859 7.439227\nPr Co C\n2 2 4\ndirect\n0.075925 0.925529 0.497174 Pr\n0.925528 0.075925 0.997174 Pr\n0.370174 0.514884 0.804610 Co\n0.514884 0.370175 0.304610 Co\n0.849526 0.490785 0.724402 C\n0.442064 0.595115 0.072818 C\n0.595114 0.442063 0.572818 C\n0.490785 0.849527 0.224402 C\n",
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{
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"created_at": "2022-09-04T14:37:10.927615Z",
"updated_at": "2022-09-04T14:37:10.927641Z",
"structure_string": "Cu4 Ge2 S6\n1.0\n6.450616 0.031214 1.035940\n1.617584 5.406402 3.215061\n0.031559 0.009430 6.528385\nCu Ge S\n4 2 6\ndirect\n0.139781 0.030798 0.168022 Cu\n0.140139 0.373206 0.496592 Cu\n0.639782 0.198820 0.831978 Cu\n0.640139 0.869797 0.503409 Cu\n0.121313 0.723458 0.824367 Ge\n0.621314 0.547824 0.175635 Ge\n0.512021 0.248922 0.496767 S\n0.012020 0.745688 0.503234 S\n0.513716 0.917164 0.169647 S\n0.013716 0.086811 0.830353 S\n0.008031 0.411534 0.166440 S\n0.508032 0.577973 0.833561 S\n",
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{
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"created_at": "2022-09-04T14:37:11.323545Z",
"updated_at": "2022-09-04T14:37:11.323567Z",
"structure_string": "Cu4 Sn2 S6\n1.0\n6.321495 -0.000000 2.248536\n3.160747 5.808882 1.124268\n0.015624 -0.000000 6.740684\nCu Sn S\n4 2 6\ndirect\n0.441360 0.162326 0.987744 Cu\n0.264073 0.494317 0.486787 Cu\n0.603686 0.837674 0.487745 Cu\n0.758390 0.505683 0.986787 Cu\n0.908662 0.185695 0.503856 Sn\n0.094358 0.814304 0.003856 Sn\n0.243402 0.816770 0.603006 S\n0.060171 0.183230 0.103006 S\n0.407854 0.476598 0.123550 S\n0.884452 0.523402 0.623550 S\n0.698757 0.830686 0.124056 S\n0.529444 0.169313 0.624055 S\n",
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{
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"created_at": "2022-09-04T14:38:11.874650Z",
"updated_at": "2022-09-04T14:38:11.874674Z",
"structure_string": "Ta4 H8 O14\n1.0\n5.289046 5.259036 -0.123259\n-0.118945 5.259036 5.416588\n5.170101 -0.000000 5.293329\nTa H O\n4 8 14\ndirect\n0.514634 0.971348 0.496972 Ta\n0.523843 0.476084 0.002602 Ta\n0.028653 0.485366 0.482954 Ta\n0.523917 0.476158 0.502528 Ta\n0.945647 0.323738 0.926234 H\n0.940272 0.908936 0.332466 H\n-0.020115 0.228791 0.265569 H\n0.201918 0.103690 0.133021 H\n0.676263 0.054354 0.695618 H\n0.771210 0.020115 -0.025756 H\n0.896311 0.798083 0.938628 H\n0.091065 0.059729 0.681674 H\n0.841585 0.411947 0.444317 O\n0.476962 0.775749 0.438439 O\n0.861627 0.395512 0.823944 O\n0.488504 0.396722 0.812394 O\n0.858853 0.800322 0.417707 O\n0.496774 0.768087 0.800674 O\n0.588054 0.158416 0.197848 O\n0.224252 0.523039 0.191149 O\n0.603278 0.511497 0.197620 O\n0.199679 0.141148 0.576880 O\n0.231914 0.503227 0.565534 O\n0.864105 0.953558 0.859454 O\n0.604489 0.138373 0.581083 O\n0.046443 0.135895 0.177116 O\n",
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"formula_full": "Ta4 H8 O14",
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{
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"created_at": "2022-09-04T14:37:13.632052Z",
"updated_at": "2022-09-04T14:37:13.632063Z",
"structure_string": "V2 O4\n1.0\n-2.515678 -1.439225 0.212202\n0.001184 2.883001 -0.425587\n0.000625 1.399998 -9.359071\nV O\n2 4\ndirect\n0.166902 0.103074 0.502198 V\n-0.168690 -0.063879 0.002100 V\n0.830654 0.509055 0.393249 O\n0.494697 0.135905 0.110833 O\n0.499416 0.637703 0.610875 O\n0.163706 0.676582 0.893204 O\n",
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}
]
}