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{
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"results": [
{
"id": "mp-1113707",
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"structure_string": "Rb2 Li1 Rh1 F6\n1.0\n0.000000 4.196226 4.196226\n4.196226 0.000000 4.196226\n4.196226 4.196226 0.000000\nRb Li Rh F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Rh\n0.758052 0.241948 0.241948 F\n0.241948 0.241948 0.758052 F\n0.241948 0.758052 0.758052 F\n0.241948 0.758052 0.241948 F\n0.758052 0.241948 0.758052 F\n0.758052 0.758052 0.241948 F\n",
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},
{
"id": "mp-1206553",
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"structure_string": "Rb2 Li1 Ru1 Cl6\n1.0\n3.556626 -6.160257 0.000000\n3.556626 6.160257 0.000000\n0.000000 0.000000 6.053254\nRb Li Ru Cl\n2 1 1 6\ndirect\n0.333333 0.666667 0.246756 Rb\n0.666667 0.333333 0.753244 Rb\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Ru\n0.842522 0.157478 0.269010 Cl\n0.157478 0.842522 0.730990 Cl\n0.842522 0.685043 0.269010 Cl\n0.157478 0.314957 0.730990 Cl\n0.314957 0.157478 0.269010 Cl\n0.685043 0.842522 0.730990 Cl\n",
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"formula_full": "Rb2 Li1 Ru1 Cl6",
"formula_reduced": "Rb2LiRuCl6",
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},
{
"id": "mp-1113705",
"created_at": "2022-09-04T14:47:28.250566Z",
"structure_string": "Rb2 Li1 Ru1 F6\n1.0\n0.000000 4.203766 4.203766\n4.203766 0.000000 4.203766\n4.203766 4.203766 0.000000\nRb Li Ru F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Ru\n0.757208 0.242792 0.242792 F\n0.242792 0.242792 0.757208 F\n0.242792 0.757208 0.757208 F\n0.242792 0.757208 0.242792 F\n0.757208 0.242792 0.757208 F\n0.757208 0.757208 0.242792 F\n",
"nsites": 10,
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],
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"formula_full": "Rb2 Li1 Ru1 F6",
"formula_reduced": "Rb2LiRuF6",
"formula_anonymous": "ABC2D6",
"energy": -50.99160419,
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"updated_at": "2021-11-28T01:38:12.886000Z",
"spacegroup": 225
},
{
"id": "mp-1199446",
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"structure_string": "Rb20 Li20 S20 O80\n1.0\n9.562695 0.000000 0.000000\n0.000000 5.323987 0.000000\n0.000000 5.239987 44.282886\nRb Li S O\n20 20 20 80\ndirect\n0.242498 0.877362 0.399122 Rb\n0.757502 0.877362 0.899122 Rb\n0.253160 0.935064 0.299851 Rb\n0.746840 0.935064 0.799851 Rb\n0.242874 0.074421 0.199981 Rb\n0.757126 0.074421 0.699981 Rb\n0.258815 0.178002 0.099149 Rb\n0.741185 0.178002 0.599149 Rb\n0.245876 0.230351 0.999325 Rb\n0.754124 0.230351 0.499325 Rb\n0.258330 0.326199 0.900056 Rb\n0.741670 0.326199 0.400056 Rb\n0.244281 0.469730 0.800117 Rb\n0.755719 0.469730 0.300117 Rb\n0.256403 0.530352 0.699673 Rb\n0.743597 0.530352 0.199673 Rb\n0.242643 0.629870 0.600266 Rb\n0.757357 0.629870 0.100266 Rb\n0.256278 0.773564 0.500207 Rb\n0.743722 0.773564 0.000207 Rb\n0.414120 0.287909 0.436006 Li\n0.585880 0.287909 0.936006 Li\n0.085419 0.381570 0.335832 Li\n0.914581 0.381570 0.835832 Li\n0.414100 0.553407 0.236233 Li\n0.585900 0.553407 0.736233 Li\n0.085322 0.590595 0.135829 Li\n0.914678 0.590595 0.635829 Li\n0.413730 0.676242 0.035908 Li\n0.586270 0.676242 0.535908 Li\n0.082523 0.839094 0.935989 Li\n0.917477 0.839094 0.435989 Li\n0.415307 0.952965 0.835843 Li\n0.584693 0.952965 0.335843 Li\n0.088227 0.980819 0.735733 Li\n0.911773 0.980819 0.235733 Li\n0.415960 0.140323 0.635824 Li\n0.584040 0.140323 0.135824 Li\n0.083035 0.252852 0.535935 Li\n0.916965 0.252852 0.035935 Li\n0.082145 0.320607 0.458377 S\n0.917855 0.320607 0.958377 S\n0.417503 0.426955 0.358463 S\n0.582497 0.426955 0.858463 S\n0.079016 0.462208 0.258254 S\n0.920984 0.462208 0.758254 S\n0.417622 0.621402 0.158408 S\n0.582378 0.621402 0.658408 S\n0.082908 0.725505 0.058448 S\n0.917092 0.725505 0.558448 S\n0.418624 0.760843 0.958388 S\n0.581376 0.760843 0.458388 S\n0.081974 0.859394 0.858462 S\n0.918026 0.859394 0.358462 S\n0.419637 0.024979 0.758250 S\n0.580363 0.024979 0.258250 S\n0.081270 0.063568 0.658083 S\n0.918730 0.063568 0.158083 S\n0.417600 0.155683 0.558310 S\n0.582400 0.155683 0.058310 S\n0.081972 0.276256 0.491940 O\n0.918028 0.276256 0.991940 O\n0.405379 0.383351 0.391973 O\n0.594621 0.383351 0.891973 O\n0.092480 0.455609 0.291691 O\n0.907520 0.455609 0.791691 O\n0.415963 0.578578 0.192097 O\n0.584037 0.578578 0.692097 O\n0.098651 0.684142 0.091957 O\n0.901349 0.684142 0.591957 O\n0.417782 0.758502 0.991830 O\n0.582218 0.758502 0.491830 O\n0.091686 0.845074 0.891974 O\n0.908314 0.845074 0.391974 O\n0.402437 0.972726 0.791648 O\n0.597563 0.972726 0.291648 O\n0.080673 0.059724 0.691643 O\n0.919327 0.059724 0.191643 O\n0.402282 0.152576 0.591667 O\n0.597718 0.152576 0.091667 O\n0.217656 0.234182 0.446795 O\n0.782344 0.234182 0.946795 O\n0.285660 0.347284 0.344562 O\n0.714340 0.347284 0.844562 O\n0.211205 0.558928 0.243565 O\n0.788795 0.558928 0.743565 O\n0.281765 0.538404 0.146690 O\n0.718235 0.538404 0.646690 O\n0.212302 0.641307 0.044009 O\n0.787698 0.641307 0.544009 O\n0.281164 0.854804 0.945986 O\n0.718836 0.854804 0.445986 O\n0.215303 0.960070 0.844733 O\n0.784697 0.960070 0.344733 O\n0.290330 0.949721 0.743070 O\n0.709670 0.949721 0.243070 O\n0.218417 0.160605 0.646034 O\n0.781583 0.160605 0.146034 O\n0.285470 0.247603 0.543167 O\n0.714530 0.247603 0.043167 O\n0.063678 0.596591 0.448637 O\n0.936322 0.596591 0.948637 O\n0.441916 0.702075 0.349069 O\n0.558084 0.702075 0.849069 O\n0.959654 0.628744 0.247617 O\n0.040346 0.628744 0.747617 O\n0.438837 0.896301 0.148556 O\n0.561163 0.896301 0.648556 O\n0.059889 0.000694 0.048975 O\n0.940111 0.000694 0.548975 O\n0.533044 0.929070 0.945290 O\n0.466956 0.929070 0.445290 O\n0.963338 0.027268 0.847579 O\n0.036662 0.027268 0.347579 O\n0.445169 0.301176 0.750016 O\n0.554831 0.301176 0.250016 O\n0.966315 0.229918 0.644955 O\n0.033685 0.229918 0.144955 O\n0.536171 0.323495 0.547531 O\n0.463829 0.323495 0.047531 O\n0.964678 0.176296 0.446522 O\n0.035322 0.176296 0.946522 O\n0.537686 0.278822 0.348528 O\n0.462314 0.278822 0.848528 O\n0.051940 0.200374 0.250765 O\n0.948060 0.200374 0.750765 O\n0.534202 0.473341 0.146999 O\n0.465798 0.473341 0.646999 O\n0.960189 0.579118 0.049359 O\n0.039811 0.579118 0.549359 O\n0.441940 0.497971 0.950868 O\n0.558060 0.497971 0.450868 O\n0.056889 0.599876 0.849980 O\n0.943111 0.599876 0.349980 O\n0.541771 0.879495 0.748754 O\n0.458229 0.879495 0.248754 O\n0.059905 0.800590 0.650430 O\n0.940095 0.800590 0.150430 O\n0.446596 0.892806 0.551415 O\n0.553404 0.892806 0.051415 O\n",
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"elements": [
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],
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"density": 2.7763316379628473,
"density_atomic": 0.06209760180176971,
"volume": 2254.515407002564,
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"formula_full": "Rb20 Li20 S20 O80",
"formula_reduced": "RbLiSO4",
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},
{
"id": "mp-1209228",
"created_at": "2022-09-04T14:39:41.468635Z",
"structure_string": "Rb1 Li3 S2 O9\n1.0\n5.076044 0.020505 -0.017305\n0.023236 5.022528 -1.392002\n-0.023970 0.023435 8.353699\nRb Li S O\n1 3 2 9\ndirect\n0.509214 0.574628 0.221773 Rb\n0.504054 0.139953 0.594981 Li\n0.996899 0.985111 0.994935 Li\n0.007013 0.763432 0.598917 Li\n0.504560 0.740634 0.804903 S\n0.003272 0.163391 0.386773 S\n0.140703 0.061277 0.517181 O\n0.628007 0.814840 0.661356 O\n0.714815 0.119887 0.395856 O\n0.542695 0.450376 0.787496 O\n0.058766 0.451443 0.413457 O\n0.105056 0.015125 0.220687 O\n0.215734 0.798796 0.803728 O\n0.621711 0.894916 0.963659 O\n0.005603 0.355890 0.955997 O\n",
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],
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"formula_full": "Rb1 Li3 S2 O9",
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},
{
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"structure_string": "Rb1 Li3 S2 O9\n1.0\n-5.101571 0.000000 0.000000\n0.157245 5.413843 0.000000\n-0.059812 -2.342434 -8.201407\nRb Li S O\n1 3 2 9\ndirect\n0.976437 0.037017 0.037647 Rb\n0.491967 0.189170 0.373609 Li\n0.988196 0.565402 0.370555 Li\n0.522084 0.401401 0.772968 Li\n0.995383 0.169733 0.569561 S\n0.491686 0.583356 0.161332 S\n0.109766 0.247801 0.422313 O\n0.006180 0.884520 0.535960 O\n0.208890 0.658458 0.761912 O\n0.705157 0.243913 0.579755 O\n0.627929 0.473402 0.280650 O\n0.587691 0.448568 0.994261 O\n0.203898 0.539900 0.170381 O\n0.553581 0.864281 0.196294 O\n0.428757 0.769179 0.748003 O\n",
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"formula_full": "Rb1 Li3 S2 O9",
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},
{
"id": "mp-1202217",
"created_at": "2022-09-04T14:47:04.601231Z",
"structure_string": "Rb8 Li8 S8 O32\n1.0\n5.387843 0.000000 0.000000\n0.000000 9.355771 0.000000\n0.000000 0.041289 17.803087\nRb Li S O\n8 8 8 32\ndirect\n0.753146 0.215422 0.250966 Rb\n0.253146 0.784578 0.249034 Rb\n0.246854 0.784578 0.749034 Rb\n0.746854 0.215422 0.750966 Rb\n0.740470 0.283316 0.500931 Rb\n0.240470 0.716684 0.999069 Rb\n0.259530 0.716684 0.499069 Rb\n0.759530 0.283316 0.000931 Rb\n0.245365 0.416382 0.162137 Li\n0.745365 0.583618 0.337863 Li\n0.754635 0.583618 0.837863 Li\n0.254635 0.416382 0.662137 Li\n0.242712 0.084415 0.411448 Li\n0.742712 0.915585 0.088552 Li\n0.757288 0.915585 0.588552 Li\n0.257288 0.084415 0.911448 Li\n0.244280 0.082298 0.102507 S\n0.744280 0.917702 0.397493 S\n0.755720 0.917702 0.897493 S\n0.255720 0.082298 0.602507 S\n0.245134 0.416225 0.352837 S\n0.745134 0.583775 0.147163 S\n0.754866 0.583775 0.647163 S\n0.254866 0.416225 0.852837 S\n0.252590 0.088543 0.019394 O\n0.752590 0.911457 0.480606 O\n0.747410 0.911457 0.980606 O\n0.247410 0.088543 0.519394 O\n0.247171 0.403085 0.269855 O\n0.747171 0.596915 0.230145 O\n0.752829 0.596915 0.730145 O\n0.252829 0.403085 0.769855 O\n0.159202 0.222960 0.132079 O\n0.659202 0.777040 0.367921 O\n0.840798 0.777040 0.867921 O\n0.340798 0.222960 0.632079 O\n0.157947 0.279540 0.386582 O\n0.657947 0.720460 0.113418 O\n0.842053 0.720460 0.613418 O\n0.342053 0.279540 0.886582 O\n0.495703 0.046944 0.132856 O\n0.995703 0.953056 0.367144 O\n0.504297 0.953056 0.867144 O\n0.004297 0.046944 0.632856 O\n0.501099 0.449687 0.380337 O\n0.001099 0.550313 0.119663 O\n0.498901 0.550313 0.619663 O\n0.998901 0.449687 0.880337 O\n0.065731 0.969257 0.127533 O\n0.565731 0.030743 0.372467 O\n0.934269 0.030743 0.872467 O\n0.434269 0.969257 0.627533 O\n0.073441 0.533698 0.376129 O\n0.573441 0.466302 0.123871 O\n0.926559 0.466302 0.623871 O\n0.426559 0.533698 0.876129 O\n",
"nsites": 56,
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"elements": [
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"formula_full": "Rb8 Li8 S8 O32",
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"spacegroup": 14
},
{
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{
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{
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{
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{
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]
}