NdOCl 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 0011852 CELL PARAMETERS: 4.0180 4.0180 6.7820 90.000 90.000 90.000 SPACE GROUP: P4/nmm X-RAY WAVELENGTH: 1.541838 Cell Volume: 109.491 Density (g/cm3): 5.935 MAX. ABS. INTENSITY / VOLUME**2: 125.7893188 RIR: 6.901 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.05 37.24 6.7820 0 0 1 2 25.77 100.00 3.4569 1 0 1 8 26.28 15.25 3.3910 0 0 2 2 31.49 76.82 2.8412 1 1 0 4 34.22 1.97 2.6205 1 1 1 8 34.61 94.51 2.5915 1 0 2 8 39.88 6.05 2.2607 0 0 3 2 41.46 33.37 2.1778 1 1 2 8 45.13 36.59 2.0090 2 0 0 4 46.07 4.98 1.9702 1 0 3 8 47.18 4.99 1.9263 2 0 1 8 51.67 18.89 1.7690 1 1 3 8 52.70 24.61 1.7370 2 1 1 16 52.98 7.78 1.7284 2 0 2 8 58.10 33.62 1.5878 2 1 2 16 59.14 17.91 1.5621 1 0 4 8 61.78 5.91 1.5017 2 0 3 8 63.94 2.98 1.4560 1 1 4 8 65.73 9.44 1.4206 2 2 0 4 66.47 2.70 1.4067 2 1 3 16 67.35 1.32 1.3904 2 2 1 8 69.27 2.09 1.3564 0 0 5 2 71.85 4.01 1.3140 3 0 1 8 72.08 2.67 1.3102 2 2 2 8 74.71 8.91 1.2706 3 1 0 8 76.47 6.29 1.2457 3 0 2 8 77.39 13.67 1.2332 2 1 4 16 78.07 3.66 1.2241 1 1 5 8 79.72 2.42 1.2028 2 2 3 8 80.77 6.11 1.1898 3 1 2 16 86.00 1.27 1.1303 0 0 6 2 86.59 3.91 1.1242 2 0 5 8 88.21 5.53 1.1076 3 1 3 16 89.02 3.93 1.0996 3 2 1 16 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.