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 = 0.0 GPa _database_code_amcsd 0008112 CELL PARAMETERS: 3.3180 3.3180 4.7170 90.000 90.000 120.000 SPACE GROUP: P-3m1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 44.973 Density (g/cm3): 3.284 MAX. ABS. INTENSITY / VOLUME**2: 43.23710866 RIR: 4.287 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.81 89.49 4.7170 0 0 1 2 31.12 30.19 2.8735 1 0 0 6 36.62 91.09 2.4540 0 1 1 6 36.62 8.91 2.4540 1 0 1 6 38.16 2.94 2.3585 0 0 2 2 50.03 19.09 1.8231 1 0 2 6 50.03 28.57 1.8231 0 1 2 6 55.38 25.12 1.6590 1 1 0 6 58.72 1.76 1.5723 0 0 3 2 59.02 19.75 1.5650 1 1 1 12 64.90 3.68 1.4367 2 0 0 6 67.96 10.84 1.3793 1 0 3 6 67.96 3.34 1.3793 0 1 3 6 68.24 1.81 1.3744 0 2 1 6 68.24 9.64 1.3744 2 0 1 6 69.24 3.57 1.3569 1 1 2 12 77.85 5.70 1.2270 2 0 2 6 77.85 3.95 1.2270 0 2 2 6 81.65 1.66 1.1793 0 0 4 2 84.99 3.38 1.1412 1 1 3 12 89.93 2.58 1.0910 1 0 4 6 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.