Fluor-schorl Ertl A, Kolitsch U, Dyar M D, Hughes J M, Rossman G R, Pieczka A, Henry D J, Pezzotta F, Prowatke S, Lengauer C L, Korner W, Brandstatter F, Francis C A, Prem M, Tillmanns E American Mineralogist 97 (2012) 1402-1416 Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls1 Locality: Blocherleitengraben, Lower Austria _database_code_amcsd 0019249 CELL PARAMETERS: 16.0393 16.0393 7.2536 90.000 90.000 120.000 SPACE GROUP: R3m X-RAY WAVELENGTH: 1.541838 Cell Volume: 1616.051 Density (g/cm3): 3.301 MAX. ABS. INTENSITY / VOLUME**2: 11.18578959 RIR: 1.103 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.77 57.79 6.4297 1 0 1 3 17.68 17.84 5.0165 0 2 1 3 19.17 20.29 4.6301 3 0 0 3 20.89 47.65 4.2530 2 1 1 6 22.17 55.75 4.0098 2 2 0 6 25.38 50.12 3.5092 0 1 2 3 26.19 4.45 3.4024 1 3 1 6 27.75 1.67 3.2149 2 0 2 3 28.50 1.83 3.1322 4 0 1 3 29.47 6.76 3.0311 4 1 0 6 29.94 51.73 2.9840 1 2 2 6 30.64 8.58 2.9175 3 2 1 6 33.95 4.92 2.6407 3 1 2 6 34.57 100.00 2.5943 0 5 1 3 35.80 3.01 2.5082 0 4 2 3 36.40 4.93 2.4684 2 4 1 6 37.19 5.79 2.4179 0 0 3 1 37.57 15.18 2.3939 2 3 2 6 38.15 12.90 2.3592 5 1 1 6 38.90 4.38 2.3151 6 0 0 3 40.56 2.21 2.2243 5 2 0 6 40.92 17.23 2.2054 5 0 2 3 41.46 7.62 2.1782 4 3 1 6 42.16 4.87 2.1432 0 3 3 3 42.16 7.06 2.1432 3 0 3 3 42.51 3.48 2.1265 4 2 2 6 43.72 9.45 2.0706 2 2 3 6 44.06 41.29 2.0555 1 5 2 6 44.56 8.18 2.0333 1 6 1 6 45.23 3.31 2.0049 4 4 0 6 47.02 21.02 1.9324 3 4 2 6 47.50 2.56 1.9140 3 5 1 6 48.14 7.42 1.8902 1 4 3 6 48.92 6.10 1.8617 6 2 1 6 49.85 1.74 1.8291 6 1 2 6 50.92 3.41 1.7932 3 3 3 6 52.13 2.55 1.7546 0 2 4 3 52.57 1.68 1.7408 5 3 2 6 53.01 1.06 1.7273 5 4 1 6 53.89 2.72 1.7012 2 6 2 6 54.91 13.75 1.6722 0 6 3 3 54.91 5.98 1.6722 6 0 3 3 55.62 10.48 1.6524 2 7 1 6 57.32 3.93 1.6074 4 0 4 3 57.45 15.88 1.6039 5 5 0 6 57.73 3.53 1.5968 4 5 2 6 58.15 1.50 1.5864 8 1 1 6 58.57 1.47 1.5761 3 2 4 6 59.39 3.77 1.5562 4 6 1 6 59.93 3.75 1.5434 9 0 0 3 60.21 4.04 1.5371 7 2 2 6 60.61 1.69 1.5277 7 3 1 6 61.02 14.09 1.5185 0 5 4 3 61.15 3.23 1.5156 8 2 0 6 62.22 3.51 1.4920 2 4 4 6 62.62 1.25 1.4835 1 8 2 6 63.41 13.89 1.4668 5 1 4 6 63.54 2.66 1.4641 1 7 3 6 63.80 4.64 1.4588 6 4 2 6 64.59 4.29 1.4429 0 1 5 3 64.72 4.78 1.4404 7 4 0 6 65.37 7.22 1.4276 6 5 1 6 65.76 8.22 1.4201 4 3 4 6 65.89 1.50 1.4177 3 6 3 6 65.89 3.11 1.4177 6 3 3 6 67.68 1.36 1.3844 3 8 1 6 68.82 8.59 1.3643 10 0 1 3 69.57 3.63 1.3513 5 6 2 6 70.33 2.71 1.3386 3 5 4 6 70.33 1.59 1.3386 0 4 5 3 70.45 3.35 1.3366 6 6 0 6 70.45 4.72 1.3366 5 5 3 6 71.45 2.14 1.3203 2 3 5 6 71.57 7.57 1.3184 10 1 0 6 71.82 2.10 1.3145 8 3 2 6 72.19 1.35 1.3086 5 7 1 6 72.68 1.18 1.3009 9 0 3 3 72.93 1.53 1.2972 0 10 2 3 73.30 1.22 1.2915 8 4 1 6 73.67 9.49 1.2859 5 0 5 3 73.79 2.93 1.2842 9 3 0 6 73.79 2.41 1.2841 2 8 3 6 74.77 1.82 1.2697 5 4 4 6 76.59 3.09 1.2441 0 11 1 3 77.07 1.24 1.2374 7 4 3 6 77.31 1.35 1.2342 4 8 2 6 77.67 1.21 1.2294 2 10 1 6 78.04 1.41 1.2245 3 4 5 6 79.24 1.74 1.2089 0 0 6 1 80.19 1.29 1.1969 6 1 5 6 80.91 3.28 1.1882 11 1 1 6 82.46 1.15 1.1697 3 0 6 3 83.52 4.90 1.1575 10 1 3 6 84.82 1.27 1.1431 1 11 2 6 85.65 1.54 1.1341 9 3 3 6 88.71 1.82 1.1027 10 0 4 3 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.