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F\n","nsites":5,"nelements":3,"elements":["Sm","Se","F"],"chemical_system":"F-Se-Sm","density":5.183897202729114,"density_atomic":0.03267969916347098,"volume":153.00018445668394,"volume_molar":18.427772942082296,"formula_full":"Sm2 Se2 F1","formula_reduced":"Sm2Se2F","formula_anonymous":"AB2C2","energy":-23.61853125,"energy_per_atom":-4.72370625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.21253125,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0180474,"is_theoretical":true,"updated_at":"2021-11-28T01:36:40.121000Z","spacegroup":123},{"id":"mp-1246382","created_at":"2022-09-04T14:44:28.373662Z","structure_string":"Y1 Mg2 Mn3 S8\n1.0\n6.463425 0.035572 3.789100\n2.187879 6.083056 3.789285\n0.048644 0.034651 7.493850\nY Mg Mn S\n1 2 3 8\ndirect\n0.500010 0.500002 0.499983 Y\n0.874138 0.874064 0.873935 Mg\n0.125870 0.125926 0.126078 Mg\n0.500000 0.500002 0.000002 Mn\n0.999996 0.500068 0.499967 Mn\n0.499961 0.999977 0.499994 Mn\n0.739600 0.739522 0.739608 S\n0.244841 0.244903 0.720607 S\n0.244761 0.720724 0.244857 S\n0.720670 0.244795 0.244802 S\n0.755235 0.279276 0.755136 S\n0.279340 0.755179 0.755209 S\n0.260406 0.260464 0.260417 S\n0.755176 0.755095 0.279407 S\n","nsites":14,"nelements":4,"elements":["Y","Mg","Mn","S"],"chemical_system":"Mg-Mn-S-Y","density":3.1739334271863826,"density_atomic":0.047883017148488125,"volume":292.37923660042463,"volume_molar":12.57677798649358,"formula_full":"Y1 Mg2 Mn3 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