SmOCl Wyckoff R W G Crystal Structures 1 (1963) 294-296 Second edition. Interscience Publishers, New York, New York Note: tetragonal PbFCl structure _database_code_amcsd 0011860 CELL PARAMETERS: 3.9820 3.9820 6.7210 90.000 90.000 90.000 SPACE GROUP: P4/nmm X-RAY WAVELENGTH: 1.541838 Cell Volume: 106.570 Density (g/cm3): 6.288 MAX. ABS. INTENSITY / VOLUME**2: 150.9795166 RIR: 7.818 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.17 43.14 6.7210 0 0 1 2 26.01 90.48 3.4259 1 0 1 8 26.52 8.37 3.3605 0 0 2 2 31.78 70.83 2.8157 1 1 0 4 34.54 3.56 2.5970 1 1 1 8 34.94 100.00 2.5682 1 0 2 8 40.25 6.93 2.2403 0 0 3 2 41.86 21.26 2.1582 1 1 2 8 45.56 33.30 1.9910 2 0 0 4 46.51 1.53 1.9525 1 0 3 8 47.64 5.87 1.9090 2 0 1 8 52.17 20.04 1.7531 1 1 3 8 53.21 22.24 1.7214 2 1 1 16 53.49 4.42 1.7129 2 0 2 8 54.62 1.54 1.6803 0 0 4 2 58.67 35.59 1.5735 2 1 2 16 59.73 12.68 1.5481 1 0 4 8 62.40 6.66 1.4882 2 0 3 8 64.59 6.01 1.4429 1 1 4 8 66.40 8.57 1.4078 2 2 0 4 68.04 1.56 1.3779 2 2 1 8 69.99 1.34 1.3442 0 0 5 2 72.60 3.61 1.3022 3 0 1 8 72.84 1.53 1.2985 2 2 2 8 73.79 2.18 1.2841 2 0 4 8 74.50 2.54 1.2736 1 0 5 8 75.50 8.18 1.2592 3 1 0 8 77.29 6.64 1.2345 3 0 2 8 78.22 9.64 1.2221 2 1 4 16 78.92 2.20 1.2131 1 1 5 8 80.59 2.71 1.1920 2 2 3 8 81.66 3.84 1.1792 3 1 2 16 86.98 1.23 1.1202 0 0 6 2 87.58 2.52 1.1141 2 0 5 8 89.22 5.90 1.0977 3 1 3 16 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.