CaAl4Si2O11 Gautron L, Angel R J, Miletich R Physics and Chemistry of Minerals 27 (1999) 47-51 Structural characterisation of the high-pressure phase CaAl4Si2O11 Note: Biso values altered to agree with the anisotropic values, as indicated by Ross Angel, March 2004 _database_code_amcsd 0008275 CELL PARAMETERS: 5.4223 5.4223 12.7041 90.000 90.000 120.000 SPACE GROUP: P6_3/mmc X-RAY WAVELENGTH: 1.541838 Cell Volume: 323.476 Density (g/cm3): 3.903 MAX. ABS. INTENSITY / VOLUME**2: 12.13462955 RIR: 1.012 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.94 14.22 6.3520 0 0 2 2 23.56 14.41 3.7760 1 0 2 12 28.10 23.90 3.1760 0 0 4 2 33.04 30.31 2.7111 1 1 0 6 34.08 76.36 2.6308 1 0 4 12 36.02 61.44 2.4935 1 1 2 12 40.98 43.13 2.2023 2 0 2 12 42.70 8.34 2.1173 0 0 6 2 43.91 3.26 2.0620 1 1 4 12 44.10 100.00 2.0534 2 0 3 12 47.08 2.94 1.9302 1 0 6 12 55.03 2.33 1.6687 1 1 6 12 58.09 4.38 1.5880 0 0 8 2 58.72 74.28 1.5724 2 0 6 12 59.01 4.57 1.5653 3 0 0 6 59.68 36.19 1.5494 2 1 4 24 60.96 11.28 1.5198 3 0 2 12 68.47 1.20 1.3703 1 1 8 12 69.05 1.02 1.3602 2 1 6 24 69.32 48.84 1.3556 2 2 0 6 71.76 9.64 1.3154 2 0 8 12 76.39 5.08 1.2468 2 2 4 12 77.90 2.92 1.2263 1 0 10 12 79.17 9.98 1.2098 2 0 9 12 79.55 10.48 1.2050 3 1 4 24 83.80 4.23 1.1544 4 0 2 12 84.16 5.26 1.1504 1 1 10 12 85.91 5.43 1.1313 4 0 3 12 87.25 1.43 1.1173 2 0 10 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.