Aragonite Ye Y, Smyth J R, Boni P American Mineralogist 97 (2012) 707-712 Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 359 K Locality: natural, unknown locality _database_code_amcsd 0018853 CELL PARAMETERS: 4.9638 7.9698 5.7545 90.000 90.000 90.000 SPACE GROUP: Pmcn X-RAY WAVELENGTH: 1.541838 Cell Volume: 227.651 Density (g/cm3): 2.924 MAX. ABS. INTENSITY / VOLUME**2: 9.538982508 RIR: 1.062 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 21.09 1.65 4.2134 1 1 0 4 26.21 100.00 3.3996 1 1 1 8 27.22 57.44 3.2761 0 2 1 4 31.08 3.79 2.8772 0 0 2 2 32.75 8.72 2.7343 1 2 1 8 33.10 51.77 2.7063 0 1 2 4 36.08 28.21 2.4893 1 0 2 4 36.19 17.14 2.4819 2 0 0 2 37.28 15.47 2.4120 0 3 1 4 37.86 40.56 2.3761 1 1 2 8 38.43 27.50 2.3422 1 3 0 4 38.60 19.21 2.3327 0 2 2 4 41.20 13.64 2.1911 2 1 1 8 42.93 19.85 2.1067 2 2 0 4 45.53 3.35 1.9924 0 4 0 2 45.87 67.67 1.9783 2 2 1 8 48.34 29.01 1.8828 0 4 1 4 48.44 17.93 1.8793 2 0 2 4 49.85 1.80 1.8292 2 1 2 8 50.23 27.40 1.8165 1 3 2 8 51.94 3.16 1.7604 1 4 1 8 52.41 28.88 1.7458 1 1 3 8 52.94 6.88 1.7297 2 3 1 8 52.98 13.10 1.7284 0 2 3 4 53.94 2.03 1.6998 2 2 2 8 56.15 2.49 1.6380 0 4 2 4 56.83 1.48 1.6201 3 1 0 4 59.25 5.51 1.5594 3 1 1 8 60.25 2.04 1.5361 0 5 1 4 61.85 5.42 1.5000 2 4 1 8 62.93 2.85 1.4769 3 2 1 8 63.38 6.12 1.4675 1 5 1 8 65.99 3.72 1.4157 0 1 4 4 66.20 2.67 1.4117 3 1 2 8 66.58 2.99 1.4045 3 3 0 4 68.65 3.28 1.3671 2 4 2 8 68.98 4.50 1.3615 1 1 4 8 69.46 1.69 1.3531 0 2 4 4 70.10 2.58 1.3423 1 5 2 8 70.95 1.57 1.3283 0 6 0 2 75.30 5.98 1.2621 3 3 2 8 76.54 2.40 1.2446 2 0 4 4 76.81 5.13 1.2409 4 0 0 2 77.05 7.80 1.2377 3 1 3 8 77.94 5.55 1.2259 1 3 4 8 78.72 1.62 1.2156 2 5 2 8 79.36 6.28 1.2073 2 4 3 8 79.47 2.44 1.2060 0 6 2 4 80.74 5.19 1.1902 1 5 3 8 82.34 7.72 1.1711 2 6 0 4 83.26 2.73 1.1605 4 2 1 8 86.22 1.29 1.1280 4 1 2 8 86.44 2.87 1.1258 3 5 1 8 87.96 2.01 1.1102 1 1 5 8 89.44 1.34 1.0956 4 2 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.