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{
"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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"updated_at": "2021-11-28T01:35:12.294000Z",
"spacegroup": 2
},
{
"id": "mp-806951",
"created_at": "2022-09-04T14:48:23.074466Z",
"structure_string": "Li1 V1 Fe1 P2 O8 F2\n1.0\n5.161550 0.000000 0.000000\n-0.700498 5.301826 0.000000\n-2.004871 -2.757036 6.553743\nLi V Fe P O F\n1 1 1 2 8 2\ndirect\n0.564639 0.207129 0.180076 Li\n0.008905 0.008779 0.995077 V\n0.494829 0.488599 0.505732 Fe\n0.916857 0.597984 0.759339 P\n0.080401 0.405108 0.239701 P\n0.444807 0.309470 0.911530 O\n0.147491 0.613181 0.604355 O\n0.032910 0.993670 0.663737 O\n0.995857 0.547950 0.122844 O\n0.947242 0.411993 0.899858 O\n0.979852 0.009281 0.335170 O\n0.871045 0.406621 0.388334 O\n0.555350 0.682787 0.084796 O\n0.621696 0.810088 0.256729 F\n0.379328 0.203338 0.741316 F\n",
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"formula_full": "Li1 V1 Fe1 P2 O8 F2",
"formula_reduced": "LiVFeP2(O4F)2",
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"updated_at": "2021-11-28T01:39:08.316000Z",
"spacegroup": 1
},
{
"id": "mp-1177768",
"created_at": "2022-09-04T14:43:17.274486Z",
"structure_string": "Li4 V2 Fe2 P4 H4 O20\n1.0\n4.740535 -1.933537 4.724984\n-2.064062 7.097945 0.030394\n-6.103287 -1.936900 4.778510\nLi V Fe P H O\n4 2 2 4 4 20\ndirect\n0.570157 0.824330 0.175074 Li\n0.070243 0.824457 0.675070 Li\n0.429851 0.175670 0.824916 Li\n0.929749 0.175521 0.324930 Li\n0.499958 0.999977 0.500004 V\n0.999976 0.999984 0.999977 V\n0.000107 0.500038 0.000117 Fe\n0.500057 0.500183 0.499991 Fe\n0.518771 0.232055 0.157462 P\n0.018721 0.232080 0.657453 P\n0.481225 0.767949 0.842534 P\n0.981276 0.767933 0.342538 P\n0.209849 0.340762 0.150332 H\n0.709842 0.340764 0.650227 H\n0.790159 0.659197 0.849669 H\n0.290124 0.659224 0.349751 H\n0.442419 0.722869 0.395279 O\n0.942451 0.722883 0.895212 O\n0.557559 0.277156 0.604685 O\n0.057551 0.277090 0.104792 O\n0.465046 0.379774 0.261420 O\n0.965052 0.379794 0.761469 O\n0.534938 0.620232 0.738564 O\n0.034960 0.620208 0.238548 O\n0.323408 0.659394 0.980092 O\n0.823417 0.659467 0.480069 O\n0.676607 0.340586 0.019906 O\n0.176579 0.340522 0.519909 O\n0.312537 0.072746 0.058391 O\n0.812542 0.072727 0.558303 O\n0.687442 0.927224 0.941620 O\n0.187434 0.927234 0.441700 O\n0.611936 0.118088 0.273379 O\n0.111938 0.118085 0.773364 O\n0.388056 0.881901 0.726626 O\n0.888061 0.881899 0.226629 O\n",
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"elements": [
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"formula_full": "Li4 V2 Fe2 P4 H4 O20",
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},
{
"id": "mp-802313",
"created_at": "2022-09-04T14:46:42.114262Z",
"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",
"nsites": 17,
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"elements": [
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"formula_full": "Li1 V1 Fe1 P2 H2 O10",
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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",
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{
"id": "mp-760043",
"created_at": "2022-09-04T14:39:12.292004Z",
"structure_string": "Li2 V2 Fe2 P4 H4 O20\n1.0\n5.302488 0.000000 0.000000\n-2.558928 6.968931 0.000000\n-1.466096 -3.446240 9.751646\nLi V Fe P H O\n2 2 2 4 4 20\ndirect\n0.434819 0.844681 0.783148 Li\n0.565181 0.155319 0.216852 Li\n0.500000 0.500000 0.500000 V\n0.500000 0.500000 0.000000 V\n0.998883 0.993232 0.253493 Fe\n0.001117 0.006768 0.746507 Fe\n0.130776 0.775790 0.976612 P\n0.126061 0.769588 0.475283 P\n0.869224 0.224210 0.023388 P\n0.873939 0.230412 0.524717 P\n0.286804 0.346941 0.247395 H\n0.713196 0.653059 0.752605 H\n0.307820 0.343537 0.745168 H\n0.692180 0.656463 0.254832 H\n0.830157 0.071995 0.597545 O\n0.181094 0.376986 0.071075 O\n0.691133 0.351286 0.564007 O\n0.778402 0.106889 0.868979 O\n0.221598 0.893111 0.131021 O\n0.669565 0.717279 0.685445 O\n0.330435 0.282721 0.314555 O\n0.169843 0.928005 0.402455 O\n0.818906 0.623014 0.928925 O\n0.682640 0.340995 0.065993 O\n0.308867 0.648714 0.435993 O\n0.187787 0.382175 0.577794 O\n0.826145 0.077649 0.106937 O\n0.683279 0.713062 0.179095 O\n0.316721 0.286938 0.820905 O\n0.795569 0.130769 0.367962 O\n0.204431 0.869231 0.632038 O\n0.317360 0.659005 0.934007 O\n0.812213 0.617825 0.422206 O\n0.173855 0.922351 0.893063 O\n",
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"formula_full": "Li2 V2 Fe2 P4 H4 O20",
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{
"id": "mp-1177767",
"created_at": "2022-09-04T14:42:53.724764Z",
"structure_string": "Li4 V2 Fe2 P4 H4 O20\n1.0\n5.449061 0.003635 -0.044674\n-2.071380 7.105945 0.015565\n1.975403 3.205029 9.433221\nLi V Fe P H O\n4 2 2 4 4 20\ndirect\n0.022446 0.451819 0.373701 Li\n0.522321 0.952374 0.873152 Li\n0.477676 0.047621 0.126864 Li\n0.977570 0.548192 0.626312 Li\n0.500031 0.000066 0.499935 V\n0.000092 0.499932 0.000033 V\n0.999967 0.999984 0.000068 Fe\n0.500023 0.500059 0.499883 Fe\n0.023252 0.892583 0.336771 P\n0.522119 0.392908 0.837508 P\n0.477784 0.607122 0.162530 P\n0.976724 0.107395 0.663205 P\n0.879564 0.157385 0.180197 H\n0.379820 0.660530 0.680668 H\n0.620221 0.339513 0.319339 H\n0.120457 0.842618 0.819774 H\n0.626263 0.302378 0.419454 O\n0.130513 0.806491 0.919230 O\n0.869547 0.193547 0.080751 O\n0.373689 0.697615 0.580554 O\n0.842465 0.014898 0.362207 O\n0.341584 0.516607 0.862694 O\n0.658222 0.483532 0.137375 O\n0.157561 0.985065 0.637779 O\n0.193483 0.507990 0.153139 O\n0.691801 0.008308 0.654648 O\n0.308100 0.991623 0.345362 O\n0.806536 0.491977 0.846799 O\n0.065308 0.885271 0.182778 O\n0.565022 0.387559 0.683097 O\n0.435120 0.612332 0.316985 O\n0.934598 0.114654 0.817197 O\n0.898001 0.674929 0.441577 O\n0.398390 0.176086 0.941923 O\n0.601674 0.823868 0.058104 O\n0.102055 0.325171 0.558408 O\n",
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{
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{
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{
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}