D Nb O5 Ti Rebbah A, Pannetier J, Raveau B Journal of Solid State Chemistry 41 (1982) 57-62 Localization of Hydrogen in the Layer Oxide H Ti Nb O5 _cod_database_code 1001207 _database_code_amcsd 0013462 CELL PARAMETERS: 6.5340 3.7760 16.6770 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 411.461 Density (g/cm3): 3.580 MAX. ABS. INTENSITY / VOLUME**2: 47.02751515 RIR: 4.278 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.61 100.00 8.3385 0 0 2 2 17.24 61.82 5.1431 1 0 2 4 20.98 2.94 4.2340 1 0 3 4 21.31 4.36 4.1693 0 0 4 2 24.17 44.17 3.6828 0 1 1 4 25.34 2.26 3.5147 1 0 4 4 27.30 28.69 3.2670 2 0 0 2 27.83 6.38 3.2061 2 0 1 4 28.58 19.80 3.1236 0 1 3 4 29.36 8.92 3.0419 2 0 2 4 30.08 3.58 2.9707 1 0 5 4 31.75 38.56 2.8181 1 1 3 8 35.08 23.67 2.5577 1 0 6 4 36.36 4.68 2.4706 2 1 0 4 36.77 4.94 2.4440 2 1 1 8 38.56 10.99 2.3348 1 1 5 8 39.93 3.71 2.2577 2 1 3 8 40.29 2.20 2.2383 1 0 7 4 42.92 7.18 2.1073 3 0 2 4 43.41 5.33 2.0846 0 0 8 2 44.69 8.44 2.0279 3 0 3 4 45.68 8.56 1.9860 1 0 8 4 47.20 1.01 1.9254 1 1 7 8 48.20 14.80 1.8880 0 2 0 2 49.50 3.14 1.8414 0 2 2 4 49.54 3.07 1.8401 3 1 2 8 50.02 3.08 1.8236 3 0 5 4 51.13 7.85 1.7866 3 1 3 8 51.57 5.47 1.7724 1 2 2 8 52.03 1.58 1.7577 1 1 8 8 52.04 3.80 1.7573 2 0 8 4 53.45 4.44 1.7144 3 0 6 4 55.22 3.82 1.6635 0 1 9 4 56.00 5.85 1.6421 3 1 5 8 56.28 6.08 1.6347 2 2 0 4 56.32 1.50 1.6335 4 0 0 2 56.57 1.19 1.6269 2 2 1 8 56.61 1.46 1.6257 4 0 1 4 57.14 4.85 1.6121 1 1 9 8 57.15 1.26 1.6118 2 0 9 4 57.45 2.07 1.6041 2 2 2 8 57.88 1.24 1.5933 2 1 8 8 58.93 1.74 1.5672 4 0 3 4 59.19 3.52 1.5610 3 1 6 8 60.91 1.13 1.5209 4 0 4 4 61.00 7.83 1.5190 1 2 6 8 61.58 1.44 1.5060 3 0 8 4 61.89 3.75 1.4992 4 1 0 4 62.67 3.95 1.4824 2 1 9 8 64.36 1.42 1.4475 4 1 3 8 66.45 3.13 1.4069 0 1 11 4 66.49 2.82 1.4062 3 2 2 8 66.86 2.37 1.3994 0 2 8 4 67.82 3.53 1.3818 3 2 3 8 68.19 1.17 1.3752 2 0 11 4 68.58 3.76 1.3684 1 2 8 8 71.99 1.69 1.3117 3 2 5 8 73.25 5.27 1.2922 2 1 11 8 73.64 2.28 1.2863 2 2 8 8 74.60 1.16 1.2721 5 0 3 4 74.80 2.73 1.2692 3 2 6 8 79.43 2.01 1.2065 1 3 3 8 79.48 1.23 1.2059 4 2 3 8 81.81 1.03 1.1773 3 2 8 8 82.27 1.21 1.1719 1 0 14 4 82.82 1.23 1.1655 4 1 9 8 83.39 1.16 1.1589 1 3 5 8 86.17 1.91 1.1286 5 1 6 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.