Perovskite Yamanaka T, Hirai M, Komatsu Y American Mineralogist 87 (2002) 1183-1189 Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure Sample: CaTiO3, x = 0.0 _database_code_amcsd 0002890 CELL PARAMETERS: 5.4043 5.4224 7.6510 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 224.207 Density (g/cm3): 4.027 MAX. ABS. INTENSITY / VOLUME**2: 34.53798227 RIR: 2.793 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 23.24 9.49 3.8278 1 1 0 4 23.25 4.46 3.8255 0 0 2 2 33.04 26.84 2.7112 0 2 0 2 33.11 100.00 2.7058 1 1 2 8 33.15 24.54 2.7022 2 0 0 2 37.18 1.64 2.4185 2 1 0 4 38.99 1.01 2.3102 1 2 1 8 39.05 3.07 2.3064 1 0 3 4 39.06 2.79 2.3060 2 1 1 8 40.79 5.41 2.2120 0 2 2 4 40.89 4.60 2.2071 2 0 2 4 44.24 1.61 2.0472 1 2 2 8 47.51 45.34 1.9139 2 2 0 4 47.54 22.46 1.9128 0 0 4 2 53.54 1.14 1.7116 2 2 2 8 53.56 1.31 1.7110 1 1 4 8 54.89 1.18 1.6727 1 3 1 8 59.05 18.82 1.5643 1 3 2 8 59.11 10.77 1.5629 0 2 4 4 59.18 10.17 1.5612 2 0 4 4 59.20 21.03 1.5608 3 1 2 8 69.32 4.85 1.3556 0 4 0 2 69.47 18.68 1.3529 2 2 4 8 69.58 4.28 1.3511 4 0 0 2 79.02 3.41 1.2117 2 4 0 4 79.13 5.74 1.2104 3 3 2 8 79.17 6.28 1.2098 1 1 6 8 79.21 3.02 1.2092 4 2 0 4 88.38 3.93 1.1060 0 4 4 4 88.63 3.51 1.1035 4 0 4 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.