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{
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"results": [
{
"id": "mp-1233288",
"created_at": "2022-09-04T14:45:25.256866Z",
"structure_string": "Mg1 Mn6 Nb4 O18\n1.0\n5.388050 -0.083426 0.040384\n-2.776152 4.799170 -0.528618\n0.138867 -1.576847 15.126152\nMg Mn Nb O\n1 6 4 18\ndirect\n0.187549 0.234671 0.540259 Mg\n0.573269 0.139761 0.695606 Mn\n0.684919 0.334974 0.976626 Mn\n0.734163 0.517631 0.434452 Mn\n0.456116 0.892162 0.483998 Mn\n0.363225 0.687562 0.001644 Mn\n0.719308 0.383947 0.181410 Mn\n0.989251 0.931326 0.867506 Nb\n0.062153 0.058910 0.142339 Nb\n0.887480 0.800756 0.666831 Nb\n0.030007 0.120943 0.338297 Nb\n0.404336 0.335072 0.094560 O\n0.687409 0.659938 0.925610 O\n0.983133 0.340011 0.247856 O\n0.351069 0.189750 0.252738 O\n0.023747 0.705287 0.083472 O\n0.619437 0.480620 0.573382 O\n0.701578 0.928634 0.759971 O\n0.023270 0.274677 0.931695 O\n0.074596 0.910885 0.425160 O\n0.239462 0.919799 0.595797 O\n0.254557 0.101768 0.760866 O\n0.819011 0.080744 0.602491 O\n0.814807 0.779167 0.242671 O\n0.306654 0.945330 0.924185 O\n0.727990 0.066171 0.092824 O\n0.726247 0.144814 0.401890 O\n0.324245 0.470743 0.432562 O\n0.864345 0.555612 0.746806 O\n",
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],
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"volume_molar": 7.959527792328804,
"formula_full": "Mg1 Mn6 Nb4 O18",
"formula_reduced": "MgMn6Nb4O18",
"formula_anonymous": "AB4C6D18",
"energy": -258.660946,
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"updated_at": "2021-11-28T01:37:00.178000Z",
"spacegroup": 1
},
{
"id": "mp-1036050",
"created_at": "2022-09-04T14:44:15.271044Z",
"structure_string": "Mg14 Mn1 Nb1 O16\n1.0\n8.628738 0.000000 0.000000\n0.000000 8.628738 0.000000\n0.000000 0.000000 4.324481\nMg Mn Nb O\n14 1 1 16\ndirect\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.251842 0.000000 0.500000 Mg\n0.748158 0.000000 0.500000 Mg\n0.245810 0.500000 0.500000 Mg\n0.754190 0.500000 0.500000 Mg\n0.000000 0.251842 0.500000 Mg\n0.500000 0.245810 0.500000 Mg\n0.000000 0.748158 0.500000 Mg\n0.500000 0.754190 0.500000 Mg\n0.248939 0.248939 0.000000 Mg\n0.751061 0.248939 0.000000 Mg\n0.248939 0.751061 0.000000 Mg\n0.751061 0.751061 0.000000 Mg\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Nb\n0.000000 0.255615 0.000000 O\n0.500000 0.238179 0.000000 O\n0.000000 0.744385 0.000000 O\n0.500000 0.761821 0.000000 O\n0.250466 0.250466 0.500000 O\n0.749534 0.250466 0.500000 O\n0.250466 0.749534 0.500000 O\n0.749534 0.749534 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.255615 0.000000 0.000000 O\n0.744385 0.000000 0.000000 O\n0.238179 0.500000 0.000000 O\n0.761821 0.500000 0.000000 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
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"O"
],
"chemical_system": "Mg-Mn-Nb-O",
"density": 3.8375554159231955,
"density_atomic": 0.09938513229009638,
"volume": 321.97974951217896,
"volume_molar": 6.059398041974634,
"formula_full": "Mg14 Mn1 Nb1 O16",
"formula_reduced": "Mg14MnNbO16",
"formula_anonymous": "ABC14D16",
"energy": -211.40641587,
"energy_per_atom": -6.6064504959375,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -198.74641587,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 7.9478841,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:27.557000Z",
"spacegroup": 123
},
{
"id": "mp-1032714",
"created_at": "2022-09-04T14:41:29.924976Z",
"structure_string": "Mg6 Mn1 Nb1 O8\n1.0\n8.766773 0.000000 0.000000\n0.000000 4.334902 0.000000\n0.000000 0.000000 4.334902\nMg Mn Nb O\n6 1 1 8\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.257639 0.000000 0.500000 Mg\n0.742361 0.000000 0.500000 Mg\n0.257639 0.500000 0.000000 Mg\n0.742361 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Nb\n0.259547 0.000000 0.000000 O\n0.740453 0.000000 0.000000 O\n0.262042 0.500000 0.500000 O\n0.737958 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
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"Mn",
"Nb",
"O"
],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.25033426551501,
"density_atomic": 0.09712290272870597,
"volume": 164.73972204777388,
"volume_molar": 6.2005362183435615,
"formula_full": "Mg6 Mn1 Nb1 O8",
"formula_reduced": "Mg6MnNbO8",
"formula_anonymous": "ABC6D8",
"energy": -110.50865892,
"energy_per_atom": -6.9067911825,
"energy_above_hull": null,
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"energy_uncorrected": -103.34465892,
"band_gap": 0.8134999999999994,
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"total_magnetization": 3.4445659,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:24.818000Z",
"spacegroup": 123
},
{
"id": "mp-1233186",
"created_at": "2022-09-04T14:43:21.419160Z",
"structure_string": "Mg1 Mn6 Nb4 O18\n1.0\n5.343829 0.000097 0.000051\n-2.671842 4.628468 0.000056\n-0.000006 0.000172 14.530730\nMg Mn Nb O\n1 6 4 18\ndirect\n0.333565 0.666873 0.197319 Mg\n0.666739 0.333272 0.681962 Mn\n0.666746 0.333007 0.991417 Mn\n0.666797 0.333019 0.477592 Mn\n0.333485 0.666349 0.504478 Mn\n0.333511 0.666352 0.986812 Mn\n0.666821 0.333433 0.213324 Mn\n0.000116 0.999731 0.856674 Nb\n0.000198 0.000174 0.140519 Nb\n0.000026 0.999829 0.643918 Nb\n0.000271 0.999762 0.357825 Nb\n0.337249 0.344317 0.092831 O\n0.691907 0.690084 0.920006 O\n0.017515 0.288892 0.246374 O\n0.272086 0.983236 0.246468 O\n0.007811 0.663195 0.093016 O\n0.676511 0.639282 0.589732 O\n0.761206 0.071359 0.742577 O\n0.998694 0.307850 0.920104 O\n0.016050 0.694126 0.419548 O\n0.360256 0.036441 0.589607 O\n0.310179 0.238504 0.742577 O\n0.963490 0.323519 0.589663 O\n0.711301 0.728296 0.246405 O\n0.309652 0.000996 0.920028 O\n0.655658 0.992560 0.092954 O\n0.678809 0.983850 0.419578 O\n0.305660 0.321210 0.419585 O\n0.928524 0.689646 0.742649 O\n",
"nsites": 29,
"nelements": 4,
"elements": [
"Mg",
"Mn",
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"O"
],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.6828647268577495,
"density_atomic": 0.08068934615446637,
"volume": 359.40308581115914,
"volume_molar": 7.46336542183848,
"formula_full": "Mg1 Mn6 Nb4 O18",
"formula_reduced": "MgMn6Nb4O18",
"formula_anonymous": "AB4C6D18",
"energy": -259.90818849,
"energy_per_atom": -8.962351327241379,
"energy_above_hull": null,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:11.813000Z",
"spacegroup": 143
},
{
"id": "mp-1046844",
"created_at": "2022-09-04T14:39:27.010121Z",
"structure_string": "Mg4 Mn2 Nb4 O16\n1.0\n3.033220 9.720747 0.000000\n-3.033220 9.720747 0.000000\n0.000000 0.029062 5.227783\nMg Mn Nb O\n4 2 4 16\ndirect\n0.587524 0.870109 0.245535 Mg\n0.129891 0.412476 0.254465 Mg\n0.412476 0.129891 0.754465 Mg\n0.870109 0.587524 0.745535 Mg\n0.339814 0.660186 0.250000 Mn\n0.660186 0.339814 0.750000 Mn\n0.714194 0.049982 0.258652 Nb\n0.950018 0.285806 0.241348 Nb\n0.285806 0.950018 0.741348 Nb\n0.049982 0.714194 0.758652 Nb\n0.818177 0.035630 0.924866 O\n0.964370 0.181824 0.575134 O\n0.181824 0.964370 0.075134 O\n0.035630 0.818176 0.424866 O\n0.565260 0.313091 0.408119 O\n0.686909 0.434740 0.091881 O\n0.434740 0.686909 0.591881 O\n0.313091 0.565260 0.908119 O\n0.706064 0.917270 0.544117 O\n0.082730 0.293936 0.955883 O\n0.163453 0.453957 0.617054 O\n0.546043 0.836547 0.882946 O\n0.836547 0.546043 0.382946 O\n0.453957 0.163453 0.117054 O\n0.917270 0.706064 0.044117 O\n0.293936 0.082730 0.455883 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
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"O"
],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.4960865310742,
"density_atomic": 0.08433779635976152,
"volume": 308.28408047432555,
"volume_molar": 7.140500487244447,
"formula_full": "Mg4 Mn2 Nb4 O16",
"formula_reduced": "Mg2MnNb2O8",
"formula_anonymous": "AB2C2D8",
"energy": -220.72904253,
"energy_per_atom": -8.489578558846153,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:34:38.445000Z",
"spacegroup": 15
},
{
"id": "mp-1032800",
"created_at": "2022-09-04T14:44:07.261345Z",
"structure_string": "Mg6 Mn1 Nb1 O8\n1.0\n8.832191 0.000000 -0.000000\n0.000000 4.334518 -0.000000\n0.000000 0.000000 4.334518\nMg Mn Nb O\n6 1 1 8\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.246514 0.000000 0.500000 Mg\n0.753486 -0.000000 0.500000 Mg\n0.246514 0.500000 0.000000 Mg\n0.753486 0.500000 -0.000000 Mg\n0.000000 -0.000000 -0.000000 Mn\n0.500000 -0.000000 -0.000000 Nb\n0.244998 -0.000000 0.000000 O\n0.755002 0.000000 -0.000000 O\n0.250609 0.500000 0.500000 O\n0.749391 0.500000 0.500000 O\n0.000000 -0.000000 0.500000 O\n0.500000 -0.000000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.500000 0.500000 -0.000000 O\n",
"nsites": 16,
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"elements": [
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],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.219600560036788,
"density_atomic": 0.09642061756683709,
"volume": 165.9396133706474,
"volume_molar": 6.245698183612604,
"formula_full": "Mg6 Mn1 Nb1 O8",
"formula_reduced": "Mg6MnNbO8",
"formula_anonymous": "ABC6D8",
"energy": -110.08659108,
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"updated_at": "2021-11-28T01:36:28.529000Z",
"spacegroup": 123
},
{
"id": "mp-1233874",
"created_at": "2022-09-04T14:48:02.783002Z",
"structure_string": "Mg1 Mn6 Nb4 O18\n1.0\n5.332338 -0.025585 -0.435356\n-2.680281 4.856805 0.104330\n-1.183161 -0.361564 15.211005\nMg Mn Nb O\n1 6 4 18\ndirect\n0.757037 0.708744 0.450823 Mg\n0.627390 0.327889 0.685481 Mn\n0.611826 0.283163 0.978491 Mn\n0.561497 0.107987 0.481818 Mn\n0.226240 0.627399 0.561597 Mn\n0.297867 0.630076 0.005038 Mn\n0.692944 0.362914 0.178363 Mn\n0.883849 0.931398 0.869736 Nb\n0.024196 0.978561 0.134896 Nb\n0.973617 0.002364 0.668931 Nb\n0.097392 0.105366 0.330067 Nb\n0.355352 0.304117 0.085343 O\n0.596763 0.635843 0.920238 O\n0.014734 0.305987 0.237536 O\n0.386056 0.110349 0.235976 O\n0.963651 0.634118 0.085795 O\n0.661279 0.744994 0.568246 O\n0.747950 0.056704 0.754744 O\n0.942691 0.250420 0.930411 O\n0.143833 0.784014 0.435490 O\n0.293318 0.021452 0.607219 O\n0.319630 0.307540 0.735867 O\n0.874156 0.304814 0.600374 O\n0.867122 0.767815 0.241363 O\n0.230544 0.931532 0.921655 O\n0.688899 0.001166 0.081284 O\n0.811800 0.055781 0.398362 O\n0.444324 0.359981 0.404723 O\n0.912378 0.699175 0.745672 O\n",
"nsites": 29,
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"elements": [
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],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.313551290440259,
"density_atomic": 0.07432579276380878,
"volume": 390.1741094394472,
"volume_molar": 8.102356579144814,
"formula_full": "Mg1 Mn6 Nb4 O18",
"formula_reduced": "MgMn6Nb4O18",
"formula_anonymous": "AB4C6D18",
"energy": -257.89450569,
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"updated_at": "2021-11-28T01:38:23.172000Z",
"spacegroup": 1
},
{
"id": "mp-1037821",
"created_at": "2022-09-04T14:46:42.111584Z",
"structure_string": "Mg30 Mn1 Nb1 O32\n1.0\n8.565594 0.000000 0.000000\n0.000000 8.565594 0.000000\n0.000000 0.000000 8.564999\nMg Mn Nb O\n30 1 1 32\ndirect\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.249012 0.249012 0.000000 Mg\n0.750988 0.249012 0.000000 Mg\n0.249012 0.750988 0.000000 Mg\n0.750988 0.750988 0.000000 Mg\n0.249967 0.249967 0.500000 Mg\n0.750033 0.249967 0.500000 Mg\n0.249967 0.750033 0.500000 Mg\n0.750033 0.750033 0.500000 Mg\n0.250693 0.000000 0.250673 Mg\n0.749307 0.000000 0.250673 Mg\n0.248263 0.500000 0.251608 Mg\n0.751737 0.500000 0.251608 Mg\n0.250693 0.000000 0.749327 Mg\n0.749307 0.000000 0.749327 Mg\n0.248263 0.500000 0.748392 Mg\n0.751737 0.500000 0.748392 Mg\n0.000000 0.250693 0.250673 Mg\n0.500000 0.248263 0.251608 Mg\n0.000000 0.749307 0.250673 Mg\n0.500000 0.751737 0.251608 Mg\n0.000000 0.250693 0.749327 Mg\n0.500000 0.248263 0.748392 Mg\n0.000000 0.749307 0.749327 Mg\n0.500000 0.751737 0.748392 Mg\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Nb\n0.000000 0.000000 0.256310 O\n0.500000 0.000000 0.251863 O\n0.000000 0.500000 0.251863 O\n0.500000 0.500000 0.262209 O\n0.000000 0.000000 0.743690 O\n0.500000 0.000000 0.748137 O\n0.000000 0.500000 0.748137 O\n0.500000 0.500000 0.737791 O\n0.250041 0.250041 0.249453 O\n0.749959 0.250041 0.249453 O\n0.250041 0.749959 0.249453 O\n0.749959 0.749959 0.249453 O\n0.250041 0.250041 0.750547 O\n0.749959 0.250041 0.750547 O\n0.250041 0.749959 0.750547 O\n0.749959 0.749959 0.750547 O\n0.254767 0.000000 0.000000 O\n0.745233 0.000000 0.000000 O\n0.238281 0.500000 0.000000 O\n0.761719 0.500000 0.000000 O\n0.250381 0.000000 0.500000 O\n0.749619 0.000000 0.500000 O\n0.248842 0.500000 0.500000 O\n0.751158 0.500000 0.500000 O\n0.000000 0.254767 0.000000 O\n0.500000 0.238281 0.000000 O\n0.000000 0.745233 0.000000 O\n0.500000 0.761719 0.000000 O\n0.000000 0.250381 0.500000 O\n0.500000 0.248842 0.500000 O\n0.000000 0.749619 0.500000 O\n0.500000 0.751158 0.500000 O\n",
"nsites": 64,
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"elements": [
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],
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"density": 3.6702978499486094,
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"volume": 628.4088425369399,
"volume_molar": 5.913072663415824,
"formula_full": "Mg30 Mn1 Nb1 O32",
"formula_reduced": "Mg30MnNbO32",
"formula_anonymous": "ABC30D32",
"energy": -414.01819342,
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"updated_at": "2021-11-28T01:37:48.129000Z",
"spacegroup": 123
},
{
"id": "mp-1036047",
"created_at": "2022-09-04T14:44:28.156132Z",
"structure_string": "Mg14 Mn1 Nb1 O16\n1.0\n4.329655 0.000000 0.000000\n0.000000 8.618480 0.000000\n0.000000 0.000000 8.639843\nMg Mn Nb O\n14 1 1 16\ndirect\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.247450 Mg\n0.500000 0.000000 0.752550 Mg\n0.500000 0.500000 0.249906 Mg\n0.500000 0.500000 0.750094 Mg\n0.500000 0.251511 0.000000 Mg\n0.500000 0.253813 0.500000 Mg\n0.500000 0.748489 0.000000 Mg\n0.500000 0.746187 0.500000 Mg\n0.000000 0.252625 0.248824 Mg\n0.000000 0.252625 0.751176 Mg\n0.000000 0.747375 0.248824 Mg\n0.000000 0.747375 0.751176 Mg\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Nb\n0.000000 0.258028 0.000000 O\n0.000000 0.262445 0.500000 O\n0.000000 0.741972 0.000000 O\n0.000000 0.737555 0.500000 O\n0.500000 0.248554 0.250450 O\n0.500000 0.248554 0.749550 O\n0.500000 0.751446 0.250450 O\n0.500000 0.751446 0.749550 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.243655 O\n0.000000 0.000000 0.756345 O\n0.000000 0.500000 0.249553 O\n0.000000 0.500000 0.750447 O\n",
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"elements": [
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],
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"density": 3.832599136518569,
"density_atomic": 0.09925677440834393,
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"volume_molar": 6.0672339957621615,
"formula_full": "Mg14 Mn1 Nb1 O16",
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},
{
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"structure_string": "Mg1 Mn6 Nb4 O18\n1.0\n5.367558 -0.074728 -0.257555\n-2.747113 4.786963 0.464523\n-0.730381 1.106840 15.262002\nMg Mn Nb O\n1 6 4 18\ndirect\n0.023127 0.927027 0.512170 Mg\n0.597975 0.319803 0.681924 Mn\n0.677418 0.397485 0.978619 Mn\n0.699010 0.272230 0.453908 Mn\n0.348825 0.575989 0.487957 Mn\n0.351174 0.722375 0.006430 Mn\n0.678635 0.354965 0.180826 Mn\n0.005273 0.116551 0.870932 Nb\n0.014719 0.003752 0.138696 Nb\n0.933067 0.967855 0.678973 Nb\n0.019891 0.994740 0.331780 Nb\n0.373800 0.349304 0.089733 O\n0.691207 0.777865 0.925736 O\n0.958672 0.243970 0.235913 O\n0.343724 0.077825 0.245185 O\n0.977991 0.675110 0.094175 O\n0.670215 0.645023 0.588516 O\n0.722140 0.059459 0.753181 O\n0.029746 0.411499 0.922705 O\n0.044067 0.686751 0.427172 O\n0.296427 0.031794 0.617030 O\n0.244039 0.205451 0.760613 O\n0.935415 0.218729 0.563774 O\n0.805391 0.707212 0.246868 O\n0.297100 0.062432 0.936604 O\n0.711956 0.049825 0.081064 O\n0.719575 0.942996 0.407606 O\n0.312105 0.253430 0.416813 O\n0.850652 0.615216 0.746933 O\n",
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],
"chemical_system": "Mg-Mn-Nb-O",
"density": 4.358371813500021,
"density_atomic": 0.07509808470708261,
"volume": 386.161645974241,
"volume_molar": 8.01903375231092,
"formula_full": "Mg1 Mn6 Nb4 O18",
"formula_reduced": "MgMn6Nb4O18",
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"spacegroup": 1
},
{
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"structure_string": "Mg1 Ta4 Mn4 Nb4 O24\n1.0\n-0.218564 0.029367 -5.239922\n0.015861 -6.064841 0.034098\n-14.734158 0.045292 -0.620044\nMg Ta Mn Nb O\n1 4 4 4 24\ndirect\n0.901772 0.147290 0.952205 Mg\n0.321263 0.667127 0.172247 Ta\n0.792714 0.828133 0.342849 Ta\n0.694311 0.837454 0.656136 Ta\n0.175973 0.674361 0.828812 Ta\n0.366275 0.152879 0.046272 Mn\n0.743872 0.333761 0.498940 Mn\n0.752693 0.656560 0.000691 Mn\n0.245609 0.666510 0.499326 Mn\n0.645144 0.357928 0.813168 Nb\n0.187698 0.171383 0.653550 Nb\n0.299772 0.166812 0.343674 Nb\n0.837527 0.337339 0.180455 Nb\n0.861513 0.142740 0.739853 O\n0.322794 0.389459 0.749360 O\n0.162875 0.373301 0.246220 O\n0.631559 0.130077 0.256353 O\n0.135287 0.865917 0.258691 O\n0.643115 0.630316 0.249470 O\n0.844249 0.643245 0.749431 O\n0.354960 0.875309 0.739658 O\n0.544598 0.170854 0.915115 O\n0.074848 0.375886 0.575445 O\n0.419091 0.374939 0.420518 O\n0.979957 0.161030 0.079424 O\n0.492577 0.858258 0.087046 O\n0.914154 0.621890 0.418279 O\n0.575133 0.626150 0.580263 O\n0.015820 0.864073 0.915977 O\n0.956822 0.432415 0.895965 O\n0.544815 0.099550 0.597036 O\n0.943784 0.095451 0.400239 O\n0.541699 0.421143 0.100564 O\n0.030189 0.604726 0.106394 O\n0.456924 0.890846 0.403244 O\n0.032527 0.894358 0.594064 O\n0.468585 0.616780 0.892884 O\n",
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"formula_full": "Mg1 Ta4 Mn4 Nb4 O24",
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{
"id": "mp-1234757",
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"structure_string": "Mg1 Ta4 Mn4 Nb4 O24\n1.0\n-0.232066 0.039517 -5.233843\n0.022072 -6.072289 0.044298\n-14.714986 0.058264 -0.658096\nMg Ta Mn Nb O\n1 4 4 4 24\ndirect\n0.101546 0.858619 0.045306 Mg\n0.347998 0.639315 0.185467 Ta\n0.809175 0.831447 0.348764 Ta\n0.705986 0.839135 0.654678 Ta\n0.166918 0.661877 0.821130 Ta\n0.241056 0.349750 0.999217 Mn\n0.757480 0.332493 0.500488 Mn\n0.635692 0.859763 0.955146 Mn\n0.258267 0.663418 0.501315 Mn\n0.676439 0.331361 0.824957 Nb\n0.201970 0.173346 0.658903 Nb\n0.316487 0.164815 0.340047 Nb\n0.819371 0.319644 0.174052 Nb\n0.848489 0.114492 0.743619 O\n0.350117 0.386965 0.753634 O\n0.149377 0.368830 0.249032 O\n0.669469 0.096033 0.259194 O\n0.148174 0.852876 0.260906 O\n0.661353 0.623939 0.250804 O\n0.850784 0.637867 0.753419 O\n0.366062 0.868443 0.743285 O\n0.500336 0.151443 0.915706 O\n0.085177 0.370760 0.580319 O\n0.433475 0.364294 0.420305 O\n0.974678 0.140464 0.079434 O\n0.452465 0.835267 0.086831 O\n0.928017 0.618210 0.422638 O\n0.585055 0.620490 0.581328 O\n0.020965 0.847143 0.917817 O\n0.968461 0.405893 0.892252 O\n0.554972 0.093695 0.597669 O\n0.963440 0.090670 0.404602 O\n0.525085 0.390496 0.109191 O\n0.049408 0.574169 0.104625 O\n0.468857 0.884599 0.405046 O\n0.047547 0.887939 0.597714 O\n0.447352 0.593791 0.901339 O\n",
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}
]
}