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Li\n0.500850 0.499373 0.500434 Li\n0.998237 0.497479 0.499834 Li\n0.247336 0.287741 0.709892 Li\n0.747558 0.008234 0.997231 Li\n0.634073 0.059790 0.373812 Mn\n0.358805 0.941873 0.621423 V\n0.862822 0.621220 0.943262 V\n0.139179 0.381025 0.056549 V\n0.250616 0.714190 0.287355 P\n0.863293 0.859591 0.663990 P\n0.364692 0.661233 0.861707 P\n0.634094 0.339460 0.132407 P\n0.135989 0.138362 0.339653 P\n0.748842 0.285003 0.714091 P\n0.088372 0.986234 0.658257 O\n0.672098 0.945153 0.615161 O\n0.034522 0.742517 0.172091 O\n0.472944 0.827794 0.262595 O\n0.393401 0.844945 0.841598 O\n0.231291 0.735561 0.461805 O\n0.906185 0.838918 0.848384 O\n0.794557 0.702042 0.544886 O\n0.177525 0.602493 0.951249 O\n0.594319 0.661211 0.986013 O\n0.266779 0.536953 0.262256 O\n0.294579 0.543044 0.704302 O\n0.703226 0.452101 0.293517 O\n0.732311 0.462230 0.737764 O\n0.406527 0.346481 0.010591 O\n0.825071 0.402547 0.047499 O\n0.204010 0.296999 0.457455 O\n0.112473 0.160537 0.158246 O\n0.771104 0.262481 0.539228 O\n0.602378 0.153795 0.142019 O\n0.530764 0.172128 0.740957 O\n0.965451 0.257706 0.830501 O\n0.325528 0.048777 0.401162 O\n0.905176 0.012453 0.336312 O\n","nsites":40,"nelements":5,"elements":["Li","Mn","V","P","O"],"chemical_system":"Li-Mn-O-P-V","density":3.141160755622716,"density_atomic":0.09236164265662473,"volume":433.08021435596413,"volume_molar":6.520175028056472,"formula_full":"Li6 Mn1 V3 P6 O24","formula_reduced":"Li6MnV3(PO4)6","formula_anonymous":"AB3C6D6E24","energy":-305.02934636,"energy_per_atom":-7.625733659,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-281.77334636,"band_gap":0.2793999999999998,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0000957,"is_theoretical":true,"updated_at":"2021-11-28T01:34:41.852000Z","spacegroup":1},{"id":"mp-849278","created_at":"2022-09-04T14:40:54.213836Z","structure_string":"Fe1 Ni3 Sn2 P6 O24\n1.0\n7.304610 -4.350026 0.000000\n7.304610 4.350026 0.000000\n4.714092 0.000000 7.075124\nFe Ni Sn P O\n1 3 2 6 24\ndirect\n0.850508 0.850508 0.850508 Fe\n0.147624 0.147624 0.147624 Ni\n0.353359 0.353359 0.353359 Ni\n0.646564 0.646564 0.646564 Ni\n0.001251 0.001251 0.001251 Sn\n0.500321 0.500321 0.500321 Sn\n0.452838 0.749041 0.045884 P\n0.749041 0.045884 0.452838 P\n0.953834 0.546214 0.250675 P\n0.250675 0.953834 0.546214 P\n0.546214 0.250675 0.953834 P\n0.045884 0.452838 0.749041 P\n0.512740 0.321423 0.102718 O\n0.102718 0.512740 0.321423 O\n0.249564 0.904559 0.066643 O\n0.321423 0.102718 0.512740 O\n0.604916 0.824232 0.003602 O\n0.438033 0.596359 0.249903 O\n0.904559 0.066643 0.249564 O\n0.596359 0.249903 0.438033 O\n0.989190 0.397926 0.178094 O\n0.249903 0.438033 0.596359 O\n0.933731 0.752243 0.092915 O\n0.178094 0.989190 0.397926 O\n0.824232 0.003602 0.604916 O\n0.066643 0.249564 0.904559 O\n0.748410 0.568150 0.403055 O\n0.003602 0.604916 0.824232 O\n0.403055 0.748410 0.568150 O\n0.092915 0.933731 0.752243 O\n0.568150 0.403055 0.748410 O\n0.397926 0.178094 0.989190 O\n0.676393 0.897688 0.489398 O\n0.752243 0.092915 0.933731 O\n0.897688 0.489398 0.676393 O\n0.489398 0.676393 0.897688 O\n","nsites":36,"nelements":5,"elements":["Fe","Ni","Sn","P","O"],"chemical_system":"Fe-Ni-O-P-Sn","density":3.8378161804563846,"density_atomic":0.080066263791566,"volume":449.62757465138714,"volume_molar":7.521445955911282,"formula_full":"Fe1 Ni3 Sn2 P6 O24","formula_reduced":"FeNi3Sn2(PO4)6","formula_anonymous":"AB2C3D6E24","energy":-264.3390568,"energy_per_atom":-7.342751577777777,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-237.9720568,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0000958,"is_theoretical":true,"updated_at":"2021-11-28T01:34:59.331000Z","spacegroup":146}]}