Lueshite Xu H, Su Y, Balmer M L, Navrotsky A Chemistry of Materials 15 (2003) 1872-1878 A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.00 Locality: synthetic _database_code_amcsd 0018687 CELL PARAMETERS: 5.5625 15.5495 5.5138 90.000 90.000 90.000 SPACE GROUP: Pbma X-RAY WAVELENGTH: 1.541838 Cell Volume: 476.911 Density (g/cm3): 4.565 MAX. ABS. INTENSITY / VOLUME**2: 63.20362859 RIR: 4.509 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 22.71 89.75 3.9159 1 0 1 4 22.88 45.27 3.8874 0 4 0 2 32.18 28.68 2.7812 2 0 0 2 32.45 100.00 2.7588 1 4 1 8 32.48 23.86 2.7569 0 0 2 2 38.23 1.08 2.3542 1 2 2 8 38.38 1.52 2.3454 0 6 1 4 39.85 2.59 2.2619 2 4 0 4 40.10 3.06 2.2488 0 4 2 4 46.37 38.85 1.9580 2 0 2 4 46.73 20.10 1.9437 0 8 0 2 52.04 9.43 1.7575 3 0 1 4 52.32 16.35 1.7487 2 4 2 8 52.43 8.00 1.7451 1 0 3 4 52.56 16.58 1.7410 1 8 1 8 57.55 19.72 1.6014 3 4 1 8 57.88 10.90 1.5932 2 8 0 4 57.92 22.49 1.5921 1 4 3 8 58.06 9.70 1.5886 0 8 2 4 67.33 4.84 1.3906 4 0 0 2 67.96 19.04 1.3794 2 8 2 8 68.01 4.32 1.3785 0 0 4 2 72.14 2.17 1.3094 4 4 0 4 72.40 2.08 1.3053 3 0 3 4 72.51 6.45 1.3036 3 8 1 8 72.80 3.53 1.2992 0 4 4 4 72.84 5.66 1.2985 1 8 3 8 73.02 1.13 1.2958 0 12 0 2 76.76 4.25 1.2416 4 0 2 4 77.07 7.02 1.2374 3 4 3 8 77.24 3.29 1.2351 2 0 4 4 77.61 7.21 1.2302 1 12 1 8 81.36 2.12 1.1827 4 4 2 8 81.83 2.54 1.1771 2 4 4 8 82.20 1.09 1.1727 0 12 2 4 85.94 4.34 1.1310 4 8 0 4 86.57 3.88 1.1244 0 8 4 4 89.97 1.64 1.0905 5 0 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.