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{
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"results": [
{
"id": "mp-764571",
"created_at": "2022-09-04T14:41:00.361011Z",
"structure_string": "Li4 V2 Fe2 P4 O16 F4\n1.0\n5.243053 0.002196 -0.009234\n-1.443060 10.674101 0.071534\n2.410597 2.473659 6.576483\nLi V Fe P O F\n4 2 2 4 16 4\ndirect\n0.272571 0.808854 0.811019 Li\n0.272200 0.307793 0.808277 Li\n0.727800 0.692207 0.191723 Li\n0.727429 0.191146 0.188981 Li\n0.000000 0.500000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.322808 0.820728 0.236690 P\n0.323233 0.321077 0.238095 P\n0.676767 0.678923 0.761905 P\n0.677192 0.179272 0.763310 P\n0.130416 0.834061 0.110950 O\n0.134308 0.334906 0.110115 O\n0.248924 0.893110 0.389365 O\n0.305378 0.670701 0.341206 O\n0.248430 0.393645 0.389828 O\n0.306195 0.170962 0.343146 O\n0.633335 0.877484 0.088188 O\n0.633193 0.375419 0.089458 O\n0.366807 0.624581 0.910542 O\n0.366665 0.122516 0.911812 O\n0.693805 0.829038 0.656854 O\n0.751570 0.606355 0.610172 O\n0.694622 0.329299 0.658794 O\n0.751076 0.106890 0.610635 O\n0.865692 0.665094 0.889885 O\n0.869584 0.165939 0.889050 O\n0.126958 0.963068 0.740419 F\n0.127331 0.463030 0.734341 F\n0.872669 0.536970 0.265659 F\n0.873042 0.036932 0.259581 F\n",
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"formula_full": "Li4 V2 Fe2 P4 O16 F4",
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"updated_at": "2021-11-28T01:35:12.294000Z",
"spacegroup": 2
},
{
"id": "mp-777388",
"created_at": "2022-09-04T14:46:04.471956Z",
"structure_string": "Li2 V2 Fe2 P4 O16 F4\n1.0\n5.156975 0.015113 0.037720\n2.405853 2.521943 6.583961\n-1.346285 -8.109254 6.492070\nLi V Fe P O F\n2 2 2 4 16 4\ndirect\n0.553688 0.370274 0.804512 Li\n0.053747 0.870302 0.304499 Li\n0.501336 0.496691 0.498597 V\n0.001408 0.996604 0.998563 V\n0.004002 0.502659 0.002378 Fe\n0.504098 0.002778 0.502324 Fe\n0.996323 0.437654 0.320623 P\n0.496373 0.937618 0.820600 P\n0.997789 0.563720 0.678205 P\n0.497826 0.063712 0.178183 P\n0.743226 0.519342 0.389087 O\n0.243257 0.019337 0.889057 O\n0.643923 0.712963 0.888870 O\n0.143977 0.212993 0.388862 O\n0.868304 0.494241 0.170550 O\n0.368428 0.994220 0.670525 O\n0.781297 0.461210 0.664502 O\n0.281400 0.961155 0.164478 O\n0.187889 0.556325 0.345697 O\n0.687930 0.056285 0.845699 O\n0.143722 0.507075 0.828424 O\n0.643735 0.007109 0.328406 O\n0.364911 0.287113 0.103941 O\n0.864919 0.787113 0.603946 O\n0.256463 0.468083 0.617083 O\n0.756539 0.968111 0.117081 O\n0.846865 0.290425 0.966377 F\n0.346887 0.790461 0.466380 F\n0.147352 0.713056 0.028975 F\n0.647419 0.213135 0.529003 F\n",
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"elements": [
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"volume": 358.7915153687943,
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"formula_full": "Li2 V2 Fe2 P4 O16 F4",
"formula_reduced": "LiVFeP2(O4F)2",
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"updated_at": "2021-11-28T01:37:20.458000Z",
"spacegroup": 1
},
{
"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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"density": 3.085092660836715,
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"formula_full": "Li2 V2 Fe2 P4 H4 O20",
"formula_reduced": "LiVFeP2(HO5)2",
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"updated_at": "2021-11-28T01:35:10.166000Z",
"spacegroup": 1
},
{
"id": "mp-759083",
"created_at": "2022-09-04T14:45:20.062369Z",
"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",
"nsites": 19,
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"elements": [
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"formula_full": "Li3 V1 Fe1 P2 H2 O10",
"formula_reduced": "Li3VFeP2(HO5)2",
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{
"id": "mp-760258",
"created_at": "2022-09-04T14:45:15.726418Z",
"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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"formula_full": "Li6 V3 Fe3 P6 H6 O30",
"formula_reduced": "Li2VFeP2(HO5)2",
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"spacegroup": 1
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{
"id": "mp-802313",
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"structure_string": "Li1 V1 Fe1 P2 H2 O10\n1.0\n5.216535 0.000000 0.000000\n-0.729339 5.250479 0.000000\n-1.945631 -2.851309 6.569425\nLi V Fe P H O\n1 1 1 2 2 10\ndirect\n0.619324 0.254504 0.154859 Li\n0.494493 0.493016 0.504243 V\n0.008579 0.009891 0.995766 Fe\n0.088261 0.414489 0.229434 P\n0.902400 0.581576 0.774099 P\n0.297108 0.590954 0.348631 H\n0.694461 0.378353 0.657197 H\n0.429026 0.257033 0.714589 O\n0.893465 0.429723 0.378560 O\n0.070850 0.007996 0.650243 O\n0.552969 0.674844 0.074748 O\n0.972644 0.534293 0.130208 O\n0.978990 0.439774 0.891369 O\n0.442859 0.313777 0.926220 O\n0.948551 0.997926 0.343425 O\n0.115909 0.577924 0.619927 O\n0.560881 0.764600 0.283943 O\n",
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"formula_full": "Li1 V1 Fe1 P2 H2 O10",
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{
"id": "mp-1177766",
"created_at": "2022-09-04T14:45:20.040027Z",
"structure_string": "Li4 V2 Fe2 P4 H4 O20\n1.0\n6.948869 0.000000 0.000000\n-0.114685 7.527058 0.000000\n-0.279098 -3.626885 6.981360\nLi V Fe P H O\n4 2 2 4 4 20\ndirect\n0.161160 0.585923 0.763176 Li\n0.338634 0.913948 0.735964 Li\n0.660938 0.085911 0.263807 Li\n0.839371 0.414199 0.237146 Li\n0.000035 0.000429 0.999927 V\n0.750514 0.250015 0.750426 V\n0.249680 0.749751 0.249793 Fe\n0.499825 0.499305 0.499746 Fe\n0.596267 0.726682 0.958902 P\n0.096774 0.226768 0.458779 P\n0.903390 0.772649 0.540603 P\n0.403472 0.273691 0.041444 P\n0.041277 0.322558 0.983373 H\n0.539889 0.820036 0.480726 H\n0.458725 0.179732 0.517412 H\n0.960240 0.677910 0.018774 H\n0.055103 0.831876 0.710896 O\n0.003748 0.688817 0.347382 O\n0.445872 0.667665 0.787955 O\n0.725317 0.905236 0.977887 O\n0.082323 0.754236 0.031932 O\n0.225311 0.405723 0.476442 O\n0.417737 0.744106 0.468442 O\n0.724565 0.549364 0.929847 O\n0.503883 0.189986 0.847383 O\n0.775620 0.950281 0.570249 O\n0.223772 0.048802 0.428823 O\n0.495070 0.810659 0.151808 O\n0.275966 0.451372 0.070821 O\n0.580144 0.256088 0.528850 O\n0.773922 0.594573 0.523798 O\n0.919806 0.246199 0.971331 O\n0.275348 0.094586 0.022019 O\n0.554369 0.332579 0.211588 O\n0.997285 0.310360 0.653217 O\n0.944645 0.167986 0.289334 O\n",
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"formula_full": "Li4 V2 Fe2 P4 H4 O20",
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{
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