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Mg\n0.043186 0.645703 0.658239 Mn\n0.439629 0.858971 0.851360 Mn\n0.891014 0.363688 0.363005 Mn\n0.607165 0.130134 0.131523 V\n0.018347 0.002566 0.982646 Cr\n0.485265 0.503804 0.507027 Cr\n0.273231 0.251931 0.540555 P\n0.276053 0.945178 0.241679 P\n0.255941 0.549711 0.946968 P\n0.734493 0.457617 0.050526 P\n0.741560 0.049703 0.749829 P\n0.721398 0.744219 0.473482 P\n0.102171 0.108405 0.304502 O\n0.093711 0.490922 0.102688 O\n0.102302 0.312431 0.491031 O\n0.256656 0.096568 0.736704 O\n0.438516 0.185809 0.374401 O\n0.293552 0.414048 0.546398 O\n0.254450 0.931969 0.081638 O\n0.303033 0.752800 0.400319 O\n0.567313 0.600220 0.981518 O\n0.291414 0.551204 0.752925 O\n0.776321 0.246991 0.064320 O\n0.584803 0.984376 0.835778 O\n0.435829 0.010254 0.181865 O\n0.221109 0.747235 0.935345 O\n0.680495 0.445458 0.256617 O\n0.428108 0.378606 0.015141 O\n0.688099 0.257685 0.607278 O\n0.773766 0.066754 0.908824 O\n0.685188 0.602240 0.448774 O\n0.545494 0.830553 0.612102 O\n0.749006 0.903877 0.270154 O\n0.896211 0.665599 0.516582 O\n0.911345 0.490410 0.925625 O\n0.927407 0.919864 0.663416 O\n","nsites":37,"nelements":6,"elements":["Mg","Mn","V","Cr","P","O"],"chemical_system":"Cr-Mg-Mn-O-P-V","density":3.1754975930605274,"density_atomic":0.07742384992111243,"volume":477.88891972821676,"volume_molar":7.778146870939628,"formula_full":"Mg1 Mn3 V1 Cr2 P6 O24","formula_reduced":"MgMn3VCr2(PO4)6","formula_anonymous":"ABC2D3E6F24","energy":-300.97757012,"energy_per_atom":-8.134528922162161,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-273.78757012,"band_gap":0.8869,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":22.0000001,"is_theoretical":true,"updated_at":"2021-11-28T01:34:47.109000Z","spacegroup":1},{"id":"mp-1233117","created_at":"2022-09-04T14:40:10.889743Z","structure_string":"K1 Ca1 Ni2 H3 Se2 O10\n1.0\n4.786080 3.188577 -2.490107\n4.997291 -3.789046 -2.864625\n1.460565 -0.524624 -8.564832\nK Ca Ni H Se O\n1 1 2 3 2 10\ndirect\n0.489760 0.463408 0.443116 K\n0.560062 0.472293 0.812643 Ca\n0.014196 0.457304 0.985919 Ni\n0.491975 0.970474 0.935285 Ni\n0.798209 0.754755 0.758343 H\n0.236924 0.282078 0.276810 H\n0.213114 0.558463 0.145006 H\n0.897485 0.898262 0.274137 Se\n0.105971 0.037721 0.726373 Se\n0.823972 0.732826 0.517251 O\n0.263360 0.179520 0.485739 O\n0.212828 0.791803 0.177580 O\n0.834917 0.189473 0.220236 O\n0.791024 0.141473 0.734119 O\n0.181863 0.742933 0.760413 O\n0.697306 0.669838 0.895908 O\n0.233097 0.410993 0.138857 O\n0.745293 0.858793 0.185184 O\n0.304026 0.282974 0.849747 O\n","nsites":19,"nelements":6,"elements":["K","Ca","Ni","H","Se","O"],"chemical_system":"Ca-H-K-Ni-O-Se","density":3.2549334116874977,"density_atomic":0.07196734574912024,"volume":264.00862505384623,"volume_molar":8.367879483833288,"formula_full":"K1 Ca1 Ni2 H3 Se2 O10","formula_reduced":"KCaNi2H3(SeO5)2","formula_anonymous":"ABC2D2E3F10","energy":-109.56166153,"energy_per_atom":-5.766403238421052,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-97.60966153,"band_gap":2.2301,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.9999344,"is_theoretical":true,"updated_at":"2021-11-28T01:34:55.035000Z","spacegroup":1}]}