Pyrochroite Parise J B, Theroux B, Li R, Loveday J S, Marshall W G, Klotz S Physics and Chemistry of Minerals 25 (1998) 130-137 Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 4.6 GPa _database_code_amcsd 0008115 CELL PARAMETERS: 3.2500 3.2500 4.4970 90.000 90.000 120.000 SPACE GROUP: P-3m1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 41.136 Density (g/cm3): 3.590 MAX. ABS. INTENSITY / VOLUME**2: 50.78155983 RIR: 4.606 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 19.74 69.42 4.4970 0 0 1 2 31.79 29.26 2.8146 1 0 0 6 37.70 90.28 2.3858 0 1 1 6 37.70 9.72 2.3858 1 0 1 6 40.10 2.44 2.2485 0 0 2 2 52.06 22.92 1.7567 0 1 2 6 52.06 20.91 1.7567 1 0 2 6 56.64 24.45 1.6250 1 1 0 6 60.59 17.04 1.5283 1 1 1 12 61.90 2.19 1.4990 0 0 3 2 66.43 3.57 1.4073 2 0 0 6 70.06 1.85 1.3431 0 2 1 6 70.06 9.84 1.3431 2 0 1 6 71.28 9.54 1.3231 1 0 3 6 71.28 2.16 1.3231 0 1 3 6 71.65 3.07 1.3171 1 1 2 12 80.52 4.52 1.1929 0 2 2 6 80.52 5.00 1.1929 2 0 2 6 86.58 1.76 1.1243 0 0 4 2 88.80 4.38 1.1018 1 1 3 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.