Goethite Nagai T, Kagi H, Yamanaka T American Mineralogist 88 (2003) 1423-1427 Variation of hydrogen bonded O...O distances in goethite at high pressure Sample at P = 0 GPa _database_code_amcsd 0003165 CELL PARAMETERS: 4.6250 9.9900 3.0370 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 140.321 Density (g/cm3): 4.158 MAX. ABS. INTENSITY / VOLUME**2: 40.99241593 RIR: 3.210 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.76 11.40 4.9950 0 2 0 2 21.17 100.00 4.1970 1 1 0 4 26.26 9.60 3.3936 1 2 0 4 33.15 42.12 2.7024 1 3 0 4 34.56 24.37 2.5950 0 2 1 4 35.36 4.28 2.5386 1 0 1 4 35.96 14.72 2.4975 0 4 0 2 36.52 65.83 2.4604 1 1 1 8 38.95 3.27 2.3125 2 0 0 2 39.83 9.33 2.2631 1 2 1 8 40.02 2.54 2.2529 2 1 0 4 41.07 14.41 2.1976 1 4 0 4 43.11 1.10 2.0985 2 2 0 4 44.90 4.23 2.0189 1 3 1 8 47.11 5.54 1.9290 0 4 1 4 50.44 9.56 1.8094 2 1 1 8 51.32 2.33 1.7804 1 4 1 8 53.04 35.56 1.7265 2 2 1 8 54.04 10.51 1.6968 2 4 0 4 55.16 3.05 1.6650 0 6 0 2 57.20 6.08 1.6104 2 3 1 8 58.81 22.79 1.5700 1 5 1 8 61.02 10.07 1.5185 0 0 2 2 61.32 4.11 1.5119 2 5 0 4 62.72 3.10 1.4813 2 4 1 8 63.11 4.15 1.4731 3 2 0 4 63.75 10.57 1.4600 0 6 1 4 65.35 6.05 1.4279 1 1 2 8 66.88 4.61 1.3990 3 3 0 4 68.22 3.98 1.3747 3 0 1 4 68.85 5.51 1.3637 1 7 0 4 68.95 2.43 1.3619 3 1 1 8 69.58 2.00 1.3512 2 6 0 4 71.13 1.82 1.3254 3 2 1 8 71.23 6.99 1.3238 1 3 2 8 72.91 2.93 1.2975 0 4 2 4 74.70 2.17 1.2707 3 3 1 8 74.80 1.11 1.2693 2 0 2 4 76.21 2.29 1.2493 1 4 2 8 79.60 3.03 1.2043 3 4 1 8 83.75 2.34 1.1549 0 8 1 4 84.32 2.68 1.1486 4 1 0 4 85.80 1.38 1.1325 3 5 1 8 85.89 3.99 1.1316 2 4 2 8 85.92 1.00 1.1312 3 6 0 4 86.80 1.27 1.1220 0 6 2 4 89.11 1.43 1.0988 2 8 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.