Rutile Swope R J, Smyth J R, Larson A C American Mineralogist 80 (1995) 448-453 H in rutile-type compounds: I. Single-crystal neutron and X-ray diffraction study of H in rutile Sample: X-ray; synthetic, T = 300 K _database_code_amcsd 0001737 CELL PARAMETERS: 4.5922 4.5922 2.9574 90.000 90.000 90.000 SPACE GROUP: P4_2/mnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 62.367 Density (g/cm3): 4.232 MAX. ABS. INTENSITY / VOLUME**2: 46.53315653 RIR: 3.580 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 27.47 100.00 3.2472 1 1 0 4 36.12 44.82 2.4864 1 0 1 8 39.24 6.49 2.2961 2 0 0 4 41.29 18.92 2.1865 1 1 1 8 44.10 6.77 2.0537 2 1 0 8 54.39 55.16 1.6869 2 1 1 16 56.70 16.47 1.6236 2 2 0 4 62.85 7.78 1.4787 0 0 2 2 64.13 7.69 1.4522 3 1 0 8 69.10 19.50 1.3594 3 0 1 8 69.90 9.44 1.3457 1 1 2 8 72.52 1.11 1.3035 3 1 1 16 76.65 1.93 1.2432 2 0 2 8 79.95 1.18 1.2000 2 1 2 16 82.45 3.87 1.1698 3 2 1 16 84.37 2.75 1.1480 4 0 0 4 87.60 1.03 1.1138 4 1 0 8 89.69 6.73 1.0932 2 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.