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{
"id": "mp-760016",
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"structure_string": "Li2 V2 Fe2 P4 H4 O20\n1.0\n5.220982 0.000000 0.000000\n-2.539037 6.995660 0.000000\n-1.208742 -3.393520 9.882054\nLi V Fe P H O\n2 2 2 4 4 20\ndirect\n0.571986 0.644292 0.793627 Li\n0.428014 0.355708 0.206373 Li\n0.000000 0.500000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.498998 0.045448 0.821637 P\n0.997190 0.446783 0.677340 P\n0.002810 0.553217 0.322660 P\n0.501002 0.954552 0.178363 P\n0.321412 0.317210 0.967519 H\n0.166560 0.174311 0.514879 H\n0.833440 0.825689 0.485121 H\n0.678588 0.682790 0.032481 H\n0.819250 0.690654 0.976625 O\n0.645173 0.279628 0.902938 O\n0.123849 0.483084 0.828808 O\n0.247917 0.956189 0.879681 O\n0.707325 0.943123 0.835852 O\n0.777480 0.540108 0.668841 O\n0.253944 0.551681 0.625292 O\n0.395248 0.019701 0.671999 O\n0.872788 0.216790 0.595660 O\n0.343688 0.201238 0.484104 O\n0.656312 0.798762 0.515896 O\n0.127212 0.783210 0.404340 O\n0.604752 0.980299 0.328001 O\n0.746056 0.448319 0.374708 O\n0.222520 0.459892 0.331159 O\n0.292675 0.056877 0.164148 O\n0.752083 0.043811 0.120319 O\n0.876151 0.516916 0.171192 O\n0.354827 0.720372 0.097062 O\n0.180750 0.309346 0.023375 O\n",
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{
"id": "mp-1177777",
"created_at": "2022-09-04T14:39:24.953866Z",
"structure_string": "Li4 V2 Fe2 P4 H4 O20\n1.0\n5.174515 0.000000 0.000000\n-2.371131 7.002390 0.000000\n-1.285506 -3.265756 10.091583\nLi V Fe P H O\n4 2 2 4 4 20\ndirect\n0.547793 0.624844 0.801218 Li\n0.952210 0.874874 0.698059 Li\n0.047790 0.125126 0.301941 Li\n0.452207 0.375156 0.198782 Li\n0.000000 0.000000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.496754 0.051529 0.819502 P\n0.005989 0.450003 0.680565 P\n0.994011 0.549997 0.319435 P\n0.503246 0.948471 0.180498 P\n0.327826 0.311269 0.968134 H\n0.167987 0.191395 0.529448 H\n0.832013 0.808605 0.470552 H\n0.672174 0.688731 0.031866 H\n0.811954 0.698951 0.975472 O\n0.627138 0.277942 0.897821 O\n0.135437 0.489832 0.828313 O\n0.246568 0.945146 0.873645 O\n0.717471 0.949153 0.830195 O\n0.785638 0.551597 0.670185 O\n0.257419 0.554622 0.624710 O\n0.367623 0.013978 0.672224 O\n0.878800 0.223778 0.603638 O\n0.314616 0.201293 0.476623 O\n0.685384 0.798707 0.523377 O\n0.121200 0.776222 0.396362 O\n0.632377 0.986022 0.327776 O\n0.742581 0.445378 0.375290 O\n0.214362 0.448403 0.329815 O\n0.282529 0.050847 0.169805 O\n0.753432 0.054854 0.126355 O\n0.864563 0.510168 0.171687 O\n0.372862 0.722058 0.102179 O\n0.188046 0.301049 0.024528 O\n",
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"elements": [
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"formula_full": "Li4 V2 Fe2 P4 H4 O20",
"formula_reduced": "Li2VFeP2(HO5)2",
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"updated_at": "2021-11-28T01:34:39.921000Z",
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},
{
"id": "mp-765988",
"created_at": "2022-09-04T14:41:00.093900Z",
"structure_string": "Li2 V2 Fe2 P4 H4 O20\n1.0\n5.318129 -0.005963 -0.041320\n2.570106 5.120938 4.729643\n-1.447091 -4.042338 9.603055\nLi V Fe P H O\n2 2 2 4 4 20\ndirect\n0.436490 0.143165 0.031794 Li\n0.436551 0.143197 0.531711 Li\n0.497262 0.505429 0.248020 V\n0.497377 0.505395 0.748038 V\n0.995361 0.996267 0.500439 Fe\n0.995420 0.995799 0.000584 Fe\n0.118134 0.230715 0.224284 P\n0.118144 0.230752 0.724293 P\n0.877041 0.773348 0.778308 P\n0.876967 0.773473 0.278316 P\n0.703383 0.344830 0.002148 H\n0.703319 0.344916 0.502015 H\n0.326458 0.667380 0.994152 H\n0.326436 0.667405 0.494113 H\n0.320093 0.719341 0.071269 O\n0.320101 0.719275 0.571262 O\n0.803428 0.373408 0.170832 O\n0.803469 0.373502 0.670700 O\n0.708657 0.638821 0.812743 O\n0.708202 0.639315 0.312615 O\n0.178033 0.081648 0.144001 O\n0.178223 0.081620 0.643976 O\n0.196748 0.124186 0.380056 O\n0.196715 0.124140 0.880046 O\n0.782979 0.894793 0.623878 O\n0.782988 0.894807 0.123875 O\n0.824179 0.920077 0.858479 O\n0.824310 0.920228 0.358446 O\n0.300472 0.352985 0.187729 O\n0.300500 0.353025 0.687746 O\n0.192158 0.630096 0.824682 O\n0.192107 0.630171 0.324645 O\n0.663569 0.280680 0.934604 O\n0.663539 0.280732 0.434513 O\n",
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"elements": [
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"formula_full": "Li2 V2 Fe2 P4 H4 O20",
"formula_reduced": "LiVFeP2(HO5)2",
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"spacegroup": 1
},
{
"id": "mp-760163",
"created_at": "2022-09-04T14:41:54.199314Z",
"structure_string": "Li2 V2 Fe2 P4 H4 O20\n1.0\n5.209476 0.000000 0.000000\n-1.942904 7.161667 0.000000\n-1.796619 -2.967145 9.644068\nLi V Fe P H O\n2 2 2 4 4 20\ndirect\n0.352344 0.126043 0.280641 Li\n0.647656 0.873957 0.719359 Li\n0.744010 0.743791 0.248441 V\n0.255990 0.256209 0.751559 V\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.614223 0.288169 0.064957 P\n0.888789 0.205196 0.436370 P\n0.111211 0.794804 0.563630 P\n0.385777 0.711831 0.935043 P\n0.147392 0.793739 0.143826 H\n0.335098 0.687208 0.346585 H\n0.664902 0.312792 0.653415 H\n0.852608 0.206261 0.856174 H\n0.791254 0.157907 0.084902 O\n0.348020 0.219838 0.110598 O\n0.446624 0.715724 0.091773 O\n0.781798 0.502964 0.153546 O\n0.703898 0.998182 0.341667 O\n0.035482 0.880655 0.165374 O\n0.161815 0.266358 0.395716 O\n0.482109 0.626197 0.342262 O\n0.712849 0.338761 0.414025 O\n0.057247 0.790376 0.407331 O\n0.942753 0.209624 0.592669 O\n0.287151 0.661239 0.585975 O\n0.517891 0.373803 0.657738 O\n0.838185 0.733642 0.604284 O\n0.964518 0.119345 0.834626 O\n0.296102 0.001818 0.658333 O\n0.218202 0.497036 0.846454 O\n0.553376 0.284276 0.908227 O\n0.651980 0.780162 0.889402 O\n0.208746 0.842093 0.915098 O\n",
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"formula_full": "Li2 V2 Fe2 P4 H4 O20",
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{
"id": "mp-760258",
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"structure_string": "Li6 V3 Fe3 P6 H6 O30\n1.0\n5.442401 0.000000 0.000000\n-2.657044 7.022899 0.000000\n-0.654856 -1.654658 14.371548\nLi V Fe P H O\n6 3 3 6 6 30\ndirect\n0.265835 0.868341 0.692713 Li\n0.065939 0.464319 0.641271 Li\n0.400444 0.797360 0.974639 Li\n0.599878 0.202692 0.025665 Li\n0.933331 0.536369 0.358570 Li\n0.733967 0.131140 0.307108 Li\n0.333774 0.334370 0.333601 V\n0.999631 0.999997 0.499455 V\n0.000207 0.999589 0.000202 V\n0.333700 0.333584 0.833838 Fe\n0.666527 0.666007 0.666232 Fe\n0.666584 0.666638 0.166759 Fe\n0.019418 0.380564 0.147927 P\n0.313368 0.953108 0.185729 P\n0.351812 0.714296 0.481337 P\n0.646616 0.286974 0.518557 P\n0.686859 0.046217 0.814490 P\n0.981931 0.619360 0.852240 P\n0.044840 0.986251 0.325688 H\n0.286211 0.345384 0.007556 H\n0.379438 0.320313 0.659727 H\n0.620822 0.679072 0.340873 H\n0.713517 0.654541 0.992332 H\n0.955554 0.013136 0.673162 H\n0.082836 0.827547 0.900739 O\n0.041573 0.838259 0.218691 O\n0.137270 0.792033 0.450081 O\n0.197162 0.540395 0.882931 O\n0.295453 0.957377 0.077822 O\n0.036371 0.374643 0.255764 O\n0.367987 0.709117 0.589018 O\n0.252122 0.506434 0.432296 O\n0.048702 0.093884 0.371900 O\n0.291408 0.495620 0.115094 O\n0.286166 0.238268 0.961683 O\n0.589543 0.837255 0.765858 O\n0.529755 0.874686 0.215024 O\n0.378584 0.428122 0.704682 O\n0.624243 0.828690 0.448890 O\n0.374381 0.172221 0.550586 O\n0.620082 0.572596 0.294727 O\n0.470212 0.124396 0.785270 O\n0.413744 0.161584 0.233883 O\n0.714262 0.761247 0.038553 O\n0.709275 0.504270 0.884868 O\n0.952200 0.904165 0.627919 O\n0.744082 0.495448 0.567764 O\n0.630770 0.292371 0.410668 O\n0.965238 0.624511 0.744619 O\n0.704438 0.042099 0.922476 O\n0.803775 0.459655 0.118500 O\n0.861457 0.209064 0.548451 O\n0.958609 0.162103 0.781851 O\n0.918092 0.172320 0.099725 O\n",
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{
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"structure_string": "Li3 V3 Fe3 P6 H6 O30\n1.0\n5.305109 0.000000 0.000000\n-2.556019 6.963572 0.000000\n-0.551544 -1.787971 14.608154\nLi V Fe P H O\n3 3 3 6 6 30\ndirect\n0.078609 0.489315 0.643319 Li\n0.587488 0.177269 0.021769 Li\n0.746180 0.155058 0.311060 Li\n0.333265 0.333211 0.833058 V\n0.666521 0.666684 0.166299 V\n0.999485 0.996731 0.501623 V\n0.334703 0.339679 0.334356 Fe\n0.666939 0.673183 0.668260 Fe\n0.997166 0.991359 0.997302 Fe\n0.019867 0.375196 0.150500 P\n0.312434 0.957383 0.182007 P\n0.354717 0.710100 0.484334 P\n0.642927 0.287320 0.516366 P\n0.690697 0.046541 0.816632 P\n0.975188 0.619139 0.849408 P\n0.045129 0.983811 0.332038 H\n0.288560 0.348837 0.001830 H\n0.376214 0.317232 0.664129 H\n0.643513 0.679333 0.335962 H\n0.689358 0.653233 0.996606 H\n0.977076 0.013017 0.670618 H\n0.068258 0.826453 0.897871 O\n0.032840 0.836926 0.213957 O\n0.148972 0.806866 0.457700 O\n0.300959 0.971809 0.078878 O\n0.031326 0.360813 0.253831 O\n0.184553 0.524805 0.875703 O\n0.366537 0.696834 0.587885 O\n0.043828 0.092810 0.376501 O\n0.265037 0.506138 0.432038 O\n0.299798 0.496476 0.118955 O\n0.287524 0.239364 0.957194 O\n0.527825 0.870086 0.211020 O\n0.378932 0.427023 0.709186 O\n0.597962 0.839152 0.768354 O\n0.634743 0.832035 0.452113 O\n0.363827 0.171989 0.550848 O\n0.411379 0.160446 0.237509 O\n0.602870 0.572083 0.285749 O\n0.481577 0.141331 0.790677 O\n0.730869 0.760873 0.047003 O\n0.697363 0.502997 0.885156 O\n0.743694 0.493489 0.568149 O\n0.934093 0.905115 0.620163 O\n0.617631 0.282465 0.411727 O\n0.804759 0.463050 0.121950 O\n0.947946 0.613377 0.744526 O\n0.717376 0.052065 0.921476 O\n0.860421 0.201837 0.545224 O\n0.968886 0.162948 0.781201 O\n0.921820 0.172484 0.095208 O\n",
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"formula_full": "Li3 V3 Fe3 P6 H6 O30",
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{
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"structure_string": "Li3 V1 Fe1 P2 H2 O10\n1.0\n-0.618746 -1.976889 4.937445\n5.443827 -0.011865 0.097735\n-2.080954 7.239829 0.021593\nLi V Fe P H O\n3 1 1 2 2 10\ndirect\n0.764799 0.405052 0.832809 Li\n0.206502 0.568339 0.192361 Li\n0.536362 0.865506 0.150343 Li\n0.009333 0.002348 0.506913 V\n0.996361 0.997970 0.993201 Fe\n0.673677 0.373231 0.227227 P\n0.322161 0.625089 0.764879 P\n0.332335 0.080316 0.355006 H\n0.656220 0.944099 0.652126 H\n0.838687 0.053543 0.712626 O\n0.745101 0.206144 0.368175 O\n0.311523 0.335973 0.656114 O\n0.375474 0.260961 0.093286 O\n0.862170 0.349249 0.106820 O\n0.140962 0.651692 0.893221 O\n0.619340 0.737642 0.913818 O\n0.690066 0.668158 0.333815 O\n0.255533 0.782290 0.619304 O\n0.167852 0.943638 0.284946 O\n",
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{
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