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{
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"results": [
{
"id": "mp-775972",
"created_at": "2022-09-04T14:47:07.189079Z",
"structure_string": "Li4 Mn2 V2 P4 O16 F4\n1.0\n5.352217 0.000000 0.000000\n-2.428941 7.073662 0.000000\n-1.367295 -3.460144 9.743980\nLi Mn V P O F\n4 2 2 4 16 4\ndirect\n0.429541 0.813216 0.041080 Li\n0.427890 0.810567 0.539866 Li\n0.573723 0.187571 0.459932 Li\n0.569788 0.188232 0.958035 Li\n0.001084 0.999348 0.498884 Mn\n0.499847 0.500259 0.748577 Mn\n0.000519 0.002609 0.002075 V\n0.497687 0.498381 0.250405 V\n0.118549 0.761522 0.221361 P\n0.878054 0.235406 0.279202 P\n0.119422 0.762815 0.722456 P\n0.882277 0.240312 0.777629 P\n0.161504 0.913622 0.142526 O\n0.825543 0.612911 0.182099 O\n0.315620 0.656759 0.177464 O\n0.780153 0.115002 0.120925 O\n0.217682 0.882545 0.379830 O\n0.682299 0.340273 0.323303 O\n0.171420 0.383218 0.318062 O\n0.834236 0.081126 0.357350 O\n0.160114 0.911684 0.639855 O\n0.825629 0.614028 0.683562 O\n0.321244 0.660962 0.679600 O\n0.782876 0.114733 0.619670 O\n0.218376 0.888496 0.879798 O\n0.681566 0.342999 0.821778 O\n0.177280 0.388654 0.816476 O\n0.844195 0.092317 0.859671 O\n0.337271 0.263615 0.068372 F\n0.649918 0.725023 0.430462 F\n0.342363 0.264664 0.560116 F\n0.672330 0.747132 0.939582 F\n",
"nsites": 32,
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"elements": [
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"V",
"P",
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"F"
],
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"density": 3.130190189052419,
"density_atomic": 0.08674322751000148,
"volume": 368.9048807448444,
"volume_molar": 6.9424909965514585,
"formula_full": "Li4 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -240.06480831,
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"energy_uncorrected": -220.48880831,
"band_gap": 0.6966999999999999,
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"is_magnetic": true,
"total_magnetization": 12.0000001,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:52.484000Z",
"spacegroup": 1
},
{
"id": "mp-776560",
"created_at": "2022-09-04T14:39:07.399780Z",
"structure_string": "Li6 Mn3 V3 P6 O24 F6\n1.0\n12.852420 2.453147 6.718852\n-0.732225 5.298493 0.055697\n-2.034457 -2.804792 6.564727\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.026830 0.401315 0.785978 Li\n0.307560 0.266696 0.880242 Li\n0.360154 0.067993 0.451485 Li\n0.638513 0.932561 0.549463 Li\n0.693607 0.733355 0.117589 Li\n0.972749 0.597959 0.215346 Li\n0.334478 0.667991 0.668083 Mn\n0.497930 0.998936 0.999979 Mn\n0.833656 0.666806 0.666895 Mn\n0.000898 0.999491 0.002571 V\n0.166795 0.331286 0.332520 V\n0.665833 0.333541 0.333485 V\n0.148106 0.972074 0.613587 P\n0.186002 0.692748 0.049758 P\n0.518784 0.361747 0.721218 P\n0.480526 0.637470 0.280333 P\n0.813990 0.304147 0.947714 P\n0.852853 0.029619 0.387817 P\n0.093078 0.064364 0.819464 O\n0.120670 0.702727 0.489636 O\n0.116916 0.199023 0.536774 O\n0.080024 0.699581 0.035337 O\n0.237744 0.596289 0.843952 O\n0.252478 0.972349 0.629972 O\n0.212260 0.962619 0.174159 O\n0.215190 0.467789 0.129054 O\n0.414276 0.361329 0.699871 O\n0.427183 0.734560 0.486078 O\n0.451631 0.869133 0.208051 O\n0.545902 0.632154 0.843434 O\n0.453438 0.368195 0.157852 O\n0.550205 0.132249 0.792498 O\n0.574248 0.274004 0.514489 O\n0.586385 0.630688 0.297442 O\n0.784145 0.534582 0.876699 O\n0.786989 0.036076 0.823947 O\n0.747836 0.034566 0.368157 O\n0.759379 0.394731 0.154621 O\n0.919452 0.299195 0.968203 O\n0.883563 0.797942 0.457076 O\n0.880900 0.297841 0.509537 O\n0.907642 0.938028 0.180518 O\n0.047474 0.286665 0.216961 F\n0.373164 0.968638 0.892151 F\n0.283302 0.363091 0.434308 F\n0.705302 0.614224 0.542920 F\n0.628305 0.053070 0.123126 F\n0.961655 0.718563 0.789649 F\n",
"nsites": 48,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1677596596193,
"density_atomic": 0.08778434544085789,
"volume": 546.7945310629283,
"volume_molar": 6.860153401789889,
"formula_full": "Li6 Mn3 V3 P6 O24 F6",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -359.78671047,
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"energy_uncorrected": -330.42271047,
"band_gap": 0.0947,
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"updated_at": "2021-11-28T01:34:24.085000Z",
"spacegroup": 1
},
{
"id": "mp-776481",
"created_at": "2022-09-04T14:46:41.673984Z",
"structure_string": "Li6 Mn3 V3 P6 O24 F6\n1.0\n5.229687 0.000000 0.000000\n1.789412 10.262150 0.000000\n1.271585 1.882581 10.269159\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.995790 0.919619 0.731092 Li\n0.668674 0.413776 0.601285 Li\n0.334781 0.746036 0.934461 Li\n0.666531 0.253219 0.065449 Li\n0.332627 0.587712 0.397908 Li\n0.003115 0.079902 0.268963 Li\n0.501841 0.999836 0.499174 Mn\n0.668610 0.333355 0.332686 Mn\n0.166435 0.333361 0.833498 Mn\n0.996940 0.998951 0.001423 V\n0.831753 0.667540 0.167150 V\n0.333376 0.666847 0.666233 V\n0.816202 0.627477 0.865612 P\n0.850509 0.705562 0.467807 P\n0.481030 0.961935 0.200310 P\n0.514190 0.038656 0.800586 P\n0.149856 0.293793 0.531233 P\n0.187169 0.372774 0.134526 P\n0.740967 0.974894 0.886596 O\n0.974395 0.677734 0.332056 O\n0.885453 0.477326 0.866769 O\n0.780968 0.854882 0.467708 O\n0.921734 0.359242 0.444713 O\n0.944729 0.299137 0.183076 O\n0.591557 0.691404 0.778668 O\n0.610131 0.631805 0.514582 O\n0.692913 0.656578 0.000911 O\n0.547615 0.813579 0.200437 O\n0.635989 0.007302 0.665097 O\n0.274668 0.964844 0.849986 O\n0.721411 0.035418 0.151420 O\n0.360574 0.992778 0.336230 O\n0.446494 0.188509 0.799639 O\n0.306093 0.339846 0.999213 O\n0.390815 0.368412 0.481805 O\n0.414348 0.307398 0.221521 O\n0.057268 0.700531 0.818794 O\n0.075383 0.641232 0.554647 O\n0.219368 0.144894 0.533224 O\n0.119720 0.521031 0.132981 O\n0.029715 0.326385 0.666567 O\n0.254731 0.025483 0.114070 O\n0.926193 0.193840 0.940013 F\n0.748412 0.131389 0.395759 F\n0.596021 0.540045 0.267534 F\n0.407967 0.471338 0.726622 F\n0.258506 0.861735 0.606829 F\n0.066437 0.800665 0.063135 F\n",
"nsites": 48,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1428774915137576,
"density_atomic": 0.08709481559169097,
"volume": 551.1235045841156,
"volume_molar": 6.9144652515626035,
"formula_full": "Li6 Mn3 V3 P6 O24 F6",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -359.62629055,
"energy_per_atom": -7.4922143864583335,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -330.26229055,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 16.0017608,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:42.545000Z",
"spacegroup": 1
},
{
"id": "mp-1393717",
"created_at": "2022-09-04T14:42:46.270326Z",
"structure_string": "Li2 Mn1 V1 P2 O8 F2\n1.0\n5.260964 0.000000 0.000000\n-0.742105 5.265937 0.000000\n-1.935802 -2.817175 6.607280\nLi Mn V P O F\n2 1 1 2 8 2\ndirect\n0.270039 0.614774 0.811902 Li\n0.729961 0.385226 0.188098 Li\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 V\n0.684834 0.362642 0.760725 P\n0.315166 0.637358 0.239275 P\n0.371488 0.251370 0.911332 O\n0.752859 0.213482 0.608507 O\n0.695846 0.664996 0.656614 O\n0.123217 0.657134 0.119911 O\n0.876783 0.342866 0.880090 O\n0.304154 0.335004 0.343386 O\n0.247141 0.786518 0.391493 O\n0.628512 0.748630 0.088668 O\n0.864682 0.075717 0.253388 F\n0.135318 0.924283 0.746612 F\n",
"nsites": 16,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.154216003109915,
"density_atomic": 0.08740902624075952,
"volume": 183.04745731784703,
"volume_molar": 6.889609710801044,
"formula_full": "Li2 Mn1 V1 P2 O8 F2",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -79.94818053,
"energy_per_atom": -4.996761283125,
"energy_above_hull": null,
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"energy_uncorrected": -70.16018053,
"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:50.677000Z",
"spacegroup": 2
},
{
"id": "mp-776087",
"created_at": "2022-09-04T14:46:16.966155Z",
"structure_string": "Li4 Mn2 V2 P4 O16 F4\n1.0\n2.763627 -2.482913 -6.642567\n4.498936 5.316848 0.080890\n3.143465 -2.806305 6.609528\nLi Mn V P O F\n4 2 2 4 16 4\ndirect\n0.077733 0.651133 0.266177 Li\n0.580995 0.151152 0.768800 Li\n0.420301 0.846991 0.233254 Li\n0.920256 0.350557 0.730088 Li\n0.500018 0.499407 0.499715 Mn\n0.249336 0.749445 0.748778 Mn\n0.000302 0.001856 0.001662 V\n0.751142 0.248784 0.250317 V\n0.222952 0.100377 0.459901 P\n0.280572 0.402904 0.041853 P\n0.717697 0.600674 0.955061 P\n0.779783 0.896161 0.544264 P\n0.104028 0.269002 0.017878 O\n0.039494 0.212350 0.426298 O\n0.462579 0.288376 0.074246 O\n0.689290 0.000706 0.348043 O\n0.400147 0.235327 0.484211 O\n0.330486 0.548380 0.213455 O\n0.825714 0.044276 0.713311 O\n0.809109 0.495168 0.150564 O\n0.187419 0.509729 0.845881 O\n0.174345 0.954584 0.289038 O\n0.671101 0.453876 0.784540 O\n0.602851 0.760616 0.519465 O\n0.314108 0.992753 0.655227 O\n0.533637 0.712725 0.920937 O\n0.964452 0.786230 0.578281 O\n0.892656 0.737364 0.980708 O\n0.767959 0.103398 0.030567 F\n0.255600 0.598526 0.520261 F\n0.742214 0.393422 0.469961 F\n0.231721 0.903754 0.977254 F\n",
"nsites": 32,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1564926853074593,
"density_atomic": 0.08747211721923114,
"volume": 365.83086150525526,
"volume_molar": 6.884640444802227,
"formula_full": "Li4 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -240.07870866,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:32.734000Z",
"spacegroup": 1
},
{
"id": "mp-776449",
"created_at": "2022-09-04T14:43:41.766889Z",
"structure_string": "Li4 Mn2 V2 P4 O16 F4\n1.0\n6.912302 0.000000 0.000000\n3.387329 6.606169 0.000000\n0.226927 0.336928 7.970900\nLi Mn V P O F\n4 2 2 4 16 4\ndirect\n0.744068 0.812285 0.825920 Li\n0.246222 0.811755 0.325457 Li\n0.753778 0.188245 0.674543 Li\n0.255932 0.187715 0.174080 Li\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 V\n0.281872 0.238715 0.837389 P\n0.781172 0.235587 0.340254 P\n0.218828 0.764413 0.659746 P\n0.718128 0.761285 0.162611 P\n0.407791 0.612491 0.767174 O\n0.278069 0.918477 0.558841 O\n0.221233 0.087190 0.939512 O\n0.328958 0.345610 0.982145 O\n0.092244 0.388526 0.728110 O\n0.837913 0.338430 0.482563 O\n0.010433 0.888109 0.767809 O\n0.508289 0.883621 0.267758 O\n0.491711 0.116379 0.732242 O\n0.989567 0.111891 0.232191 O\n0.162087 0.661570 0.517437 O\n0.907756 0.611474 0.271890 O\n0.671042 0.654390 0.017855 O\n0.778767 0.912810 0.060488 O\n0.721931 0.081523 0.441159 O\n0.592209 0.387509 0.232826 O\n0.765797 0.262139 0.899673 F\n0.729728 0.737034 0.609417 F\n0.270272 0.262966 0.390583 F\n0.234203 0.737861 0.100327 F\n",
"nsites": 32,
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"elements": [
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"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1725274054901806,
"density_atomic": 0.08791646829595917,
"volume": 363.98186392424486,
"volume_molar": 6.849843808246776,
"formula_full": "Li4 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -239.99276725,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.051000Z",
"spacegroup": 2
},
{
"id": "mp-776477",
"created_at": "2022-09-04T14:41:28.727453Z",
"structure_string": "Li6 Mn3 V3 P6 O24 F6\n1.0\n5.238439 0.000000 0.000000\n1.746099 10.204286 0.000000\n1.128360 1.890451 10.292538\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.661435 0.749407 0.565315 Li\n0.338565 0.250593 0.434685 Li\n0.997995 0.578236 0.765819 Li\n0.331900 0.085928 0.898062 Li\n0.002005 0.421764 0.234181 Li\n0.668100 0.914072 0.101938 Li\n0.165012 0.833001 0.334758 Mn\n0.000000 0.500000 0.500000 Mn\n0.834988 0.166999 0.665242 Mn\n0.662613 0.832057 0.834577 V\n0.500000 0.500000 0.000000 V\n0.337387 0.167943 0.165423 V\n0.479308 0.460166 0.697441 P\n0.520692 0.539834 0.302559 P\n0.148774 0.795486 0.034713 P\n0.177736 0.870940 0.634333 P\n0.822264 0.129060 0.365667 P\n0.851226 0.204514 0.965287 P\n0.403353 0.806682 0.721619 O\n0.643462 0.510310 0.168097 O\n0.547797 0.309890 0.697911 O\n0.452203 0.690110 0.302089 O\n0.596647 0.193318 0.278381 O\n0.611084 0.131439 0.012958 O\n0.255281 0.527077 0.607590 O\n0.283429 0.464508 0.346070 O\n0.356538 0.489690 0.831903 O\n0.215791 0.645019 0.036234 O\n0.302465 0.839984 0.499607 O\n0.938269 0.797030 0.681472 O\n0.388916 0.868561 0.987042 O\n0.027272 0.827138 0.169398 O\n0.112055 0.021462 0.633456 O\n0.972728 0.172862 0.830602 O\n0.061731 0.202970 0.318528 O\n0.077132 0.142194 0.052575 O\n0.716571 0.535492 0.653930 O\n0.744719 0.472923 0.392410 O\n0.887945 0.978538 0.366544 O\n0.784209 0.354981 0.963766 O\n0.697535 0.160016 0.500393 O\n0.922868 0.857806 0.947425 O\n0.591763 0.026397 0.772576 F\n0.408237 0.973603 0.227424 F\n0.267644 0.365932 0.103762 F\n0.077230 0.302666 0.561801 F\n0.922770 0.697334 0.438199 F\n0.732356 0.634068 0.896238 F\n",
"nsites": 48,
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"elements": [
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"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.148251316831835,
"density_atomic": 0.08724373400367605,
"volume": 550.182778719415,
"volume_molar": 6.902662785783853,
"formula_full": "Li6 Mn3 V3 P6 O24 F6",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -360.10418487,
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"updated_at": "2021-11-28T01:35:26.831000Z",
"spacegroup": 2
},
{
"id": "mp-776504",
"created_at": "2022-09-04T14:40:28.756976Z",
"structure_string": "Li6 Mn3 V3 P6 O24 F6\n1.0\n5.190327 0.000000 0.000000\n-2.425034 7.138734 0.000000\n-0.687111 -1.213700 14.863756\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.769539 0.849650 0.038954 Li\n0.565482 0.485226 0.294600 Li\n0.230461 0.150350 0.961046 Li\n0.434518 0.514774 0.705400 Li\n0.103053 0.185765 0.372433 Li\n0.896947 0.814235 0.627567 Li\n0.834273 0.833592 0.832891 Mn\n0.500000 0.000000 0.500000 Mn\n0.165727 0.166408 0.167109 Mn\n0.832963 0.332826 0.833498 V\n0.500000 0.500000 0.500000 V\n0.167037 0.667174 0.166502 V\n0.722758 0.283906 0.049132 P\n0.608198 0.049116 0.285523 P\n0.391802 0.950884 0.714477 P\n0.277242 0.716094 0.950868 P\n0.063070 0.621382 0.381113 P\n0.936930 0.378618 0.618887 P\n0.817591 0.180601 0.570276 O\n0.692859 0.048182 0.386986 O\n0.595873 0.835141 0.723316 O\n0.492309 0.853085 0.237462 O\n0.638693 0.286009 0.948127 O\n0.791821 0.504716 0.418439 O\n0.733359 0.493170 0.611684 O\n0.447538 0.166744 0.085710 O\n0.507691 0.146915 0.762538 O\n0.404127 0.164859 0.276684 O\n0.307141 0.951818 0.613014 O\n0.552462 0.833256 0.914290 O\n0.115065 0.834525 0.750446 O\n0.361307 0.713991 0.051873 O\n0.266641 0.506830 0.388316 O\n0.159236 0.519582 0.903574 O\n0.208179 0.495284 0.581561 O\n0.927986 0.168394 0.057486 O\n0.884935 0.165475 0.249554 O\n0.025401 0.372645 0.719262 O\n0.182409 0.819399 0.429724 O\n0.072014 0.831606 0.942514 O\n0.974599 0.627355 0.280738 O\n0.840764 0.480418 0.096426 O\n0.672388 0.535278 0.808286 F\n0.659734 0.780827 0.525173 F\n0.340266 0.219173 0.474827 F\n0.327612 0.464722 0.191714 F\n0.004970 0.868654 0.141082 F\n0.995030 0.131346 0.858918 F\n",
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],
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"formula_full": "Li6 Mn3 V3 P6 O24 F6",
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"updated_at": "2021-11-28T01:35:01.444000Z",
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},
{
"id": "mp-1391284",
"created_at": "2022-09-04T14:39:59.754748Z",
"structure_string": "Li1 Mn1 V1 P2 O8 F2\n1.0\n5.191618 0.000000 0.000000\n-0.641887 5.230456 0.000000\n-1.884251 -2.639386 6.630731\nLi Mn V P O F\n1 1 1 2 8 2\ndirect\n0.921345 0.389686 0.177115 Li\n0.506292 0.996346 0.504202 Mn\n0.999041 0.004332 0.993137 V\n0.440629 0.358328 0.759292 P\n0.555079 0.643782 0.241363 P\n0.274383 0.225128 0.911418 O\n0.360581 0.220404 0.603195 O\n0.365085 0.663543 0.664559 O\n0.241977 0.669175 0.131577 O\n0.747627 0.315063 0.891877 O\n0.643901 0.337038 0.335823 O\n0.646929 0.790727 0.391527 O\n0.719485 0.760969 0.086728 O\n0.117448 0.067960 0.245821 F\n0.879254 0.941414 0.750950 F\n",
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"elements": [
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],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1426362160814794,
"density_atomic": 0.08330816470374859,
"volume": 180.05438066414456,
"volume_molar": 7.2287521654273394,
"formula_full": "Li1 Mn1 V1 P2 O8 F2",
"formula_reduced": "LiMnVP2(O4F)2",
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"energy": -66.44440912,
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"updated_at": "2021-11-28T01:34:45.457000Z",
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},
{
"id": "mp-1177877",
"created_at": "2022-09-04T14:46:53.075929Z",
"structure_string": "Li4 Mn2 V2 P4 O16 F4\n1.0\n5.254595 0.001438 0.063233\n2.506490 2.439559 6.680847\n-1.300205 -8.091812 6.568456\nLi Mn V P O F\n4 2 2 4 16 4\ndirect\n0.463446 0.619989 0.192328 Li\n0.963284 0.119968 0.692227 Li\n0.536650 0.379984 0.807697 Li\n0.036704 0.880041 0.307767 Li\n0.499838 0.999801 0.500022 Mn\n0.999861 0.500120 0.999894 Mn\n0.500087 0.499892 0.500007 V\n0.000046 0.000010 0.000023 V\n0.005191 0.442060 0.319157 P\n0.505098 0.942109 0.819062 P\n0.994902 0.557923 0.680821 P\n0.494862 0.057989 0.180950 P\n0.747391 0.537219 0.373762 O\n0.247217 0.037234 0.873758 O\n0.252781 0.462767 0.626234 O\n0.752776 0.962869 0.126292 O\n0.648247 0.716072 0.893392 O\n0.148245 0.215930 0.393506 O\n0.351635 0.283959 0.106552 O\n0.851702 0.784072 0.606493 O\n0.866117 0.489948 0.167434 O\n0.365824 0.989856 0.667401 O\n0.133976 0.510125 0.832535 O\n0.634013 0.010154 0.332620 O\n0.791486 0.449822 0.669942 O\n0.291601 0.949708 0.170093 O\n0.208562 0.550159 0.330080 O\n0.708506 0.050316 0.829933 O\n0.827034 0.292069 0.962588 F\n0.326948 0.792058 0.462675 F\n0.172997 0.707961 0.037395 F\n0.672975 0.207817 0.537360 F\n",
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"elements": [
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],
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"density": 3.145181746067556,
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"volume": 367.14648997465645,
"volume_molar": 6.909399506772844,
"formula_full": "Li4 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li2MnVP2(O4F)2",
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"spacegroup": 2
},
{
"id": "mp-890597",
"created_at": "2022-09-04T14:47:12.402212Z",
"structure_string": "Li4 Mn2 V2 P4 O16 F4\n1.0\n10.430112 0.000000 0.000000\n-0.701628 5.306029 0.000000\n-2.028244 -2.718284 6.665854\nLi Mn V P O F\n4 2 2 4 16 4\ndirect\n0.813216 0.041080 0.429541 Li\n0.810567 0.539866 0.427890 Li\n0.187571 0.459932 0.573723 Li\n0.188232 0.958035 0.569788 Li\n0.999348 0.498884 0.001084 Mn\n0.500259 0.748577 0.499847 Mn\n0.002609 0.002075 0.000519 V\n0.498381 0.250405 0.497687 V\n0.761522 0.221361 0.118549 P\n0.235406 0.279202 0.878054 P\n0.762815 0.722456 0.119422 P\n0.240312 0.777629 0.882277 P\n0.913622 0.142526 0.161504 O\n0.612911 0.182099 0.825543 O\n0.656759 0.177464 0.315620 O\n0.115002 0.120925 0.780153 O\n0.882545 0.379830 0.217682 O\n0.340273 0.323303 0.682299 O\n0.383218 0.318062 0.171420 O\n0.081126 0.357350 0.834236 O\n0.911684 0.639855 0.160114 O\n0.614028 0.683562 0.825629 O\n0.660962 0.679600 0.321244 O\n0.114733 0.619670 0.782876 O\n0.888496 0.879798 0.218376 O\n0.342999 0.821778 0.681566 O\n0.388654 0.816476 0.177280 O\n0.092317 0.859671 0.844195 O\n0.263615 0.068372 0.337271 F\n0.725023 0.430462 0.649918 F\n0.264664 0.560116 0.342363 F\n0.747132 0.939582 0.672330 F\n",
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"V",
"P",
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"F"
],
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"density": 3.1301902803742454,
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"volume": 368.9048699822183,
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"formula_full": "Li4 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li2MnVP2(O4F)2",
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},
{
"id": "mp-752825",
"created_at": "2022-09-04T14:45:36.218876Z",
"structure_string": "Li6 Mn2 V2 P4 O16 F4\n1.0\n-0.687021 5.392654 -0.006117\n-10.552667 -0.095520 0.327486\n2.417997 2.505506 6.580874\nLi Mn V P O F\n6 2 2 4 16 4\ndirect\n0.597976 0.868159 0.845217 Li\n0.598016 0.368170 0.845248 Li\n0.043431 0.254313 0.486607 Li\n0.043380 0.754319 0.486619 Li\n0.416393 0.122676 0.139263 Li\n0.416420 0.622694 0.139293 Li\n0.991326 0.505664 0.502192 Mn\n0.991044 0.005415 0.502236 Mn\n0.999682 0.000074 0.000903 V\n0.999678 0.500049 0.000870 V\n0.354393 0.672683 0.763225 P\n0.354381 0.172700 0.763215 P\n0.641718 0.328117 0.240034 P\n0.641689 0.828130 0.240025 P\n0.241276 0.821136 0.923243 O\n0.241311 0.321151 0.923273 O\n0.209794 0.643194 0.612333 O\n0.209814 0.143172 0.612288 O\n0.648387 0.670166 0.666819 O\n0.648417 0.170171 0.666906 O\n0.670008 0.429814 0.119655 O\n0.669974 0.929813 0.119655 O\n0.326556 0.569320 0.880094 O\n0.326552 0.069315 0.880086 O\n0.346556 0.330971 0.337867 O\n0.346540 0.830976 0.337945 O\n0.789214 0.358819 0.388935 O\n0.789179 0.858810 0.388900 O\n0.755586 0.179146 0.080712 O\n0.755604 0.679174 0.080758 O\n0.089685 0.578283 0.255794 F\n0.089666 0.078238 0.255790 F\n0.917125 0.424171 0.742878 F\n0.917112 0.924120 0.742873 F\n",
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],
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"formula_full": "Li6 Mn2 V2 P4 O16 F4",
"formula_reduced": "Li3MnVP2(O4F)2",
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"total_magnetization": 1e-07,
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"updated_at": "2021-11-28T01:37:11.241000Z",
"spacegroup": 1
}
]
}