Qandilite Wechsler B A, Von Dreele R B Acta Crystallographica B45 (1989) 542-549 Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 773 K _database_code_amcsd 0009833 CELL PARAMETERS: 5.9748 5.9748 8.4140 90.000 90.000 90.000 SPACE GROUP: P4_122 X-RAY WAVELENGTH: 1.541838 Cell Volume: 300.365 Density (g/cm3): 3.548 MAX. ABS. INTENSITY / VOLUME**2: 16.71913848 RIR: 1.534 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 14.83 9.20 5.9748 1 0 0 4 18.21 69.47 4.8715 1 0 1 8 23.56 12.88 3.7756 1 1 1 8 25.90 8.24 3.4398 1 0 2 8 29.91 10.16 2.9874 2 0 0 4 29.97 20.49 2.9811 1 1 2 8 33.54 1.73 2.6720 2 1 0 8 35.24 100.00 2.5467 2 1 1 8 35.35 51.86 2.5389 1 0 3 8 36.90 1.58 2.4358 2 0 2 8 42.81 58.36 2.1124 2 2 0 4 43.00 29.07 2.1035 0 0 4 2 46.97 1.32 1.9346 2 1 3 8 49.44 2.19 1.8435 3 1 1 8 53.14 6.57 1.7236 3 1 2 8 53.26 3.27 1.7199 2 0 4 8 56.61 37.46 1.6259 3 2 1 8 56.69 6.08 1.6238 3 0 3 8 56.84 18.11 1.6198 1 0 5 8 59.09 1.58 1.5633 1 1 5 8 60.00 2.43 1.5418 3 2 2 8 62.14 32.43 1.4937 4 0 0 4 62.29 64.89 1.4905 2 2 4 8 65.34 2.71 1.4281 4 1 1 8 65.42 2.81 1.4267 3 2 3 8 65.56 2.42 1.4239 2 1 5 8 70.48 1.15 1.3360 4 2 0 8 70.52 1.10 1.3354 3 3 2 8 70.79 1.09 1.3309 1 1 6 8 73.57 9.92 1.2874 4 1 3 8 73.70 4.50 1.2854 3 0 5 8 74.52 2.58 1.2733 4 2 2 8 74.79 1.32 1.2694 2 0 6 8 78.54 10.80 1.2179 4 0 4 8 81.33 1.42 1.1831 5 0 1 8 81.52 2.78 1.1807 3 2 5 8 86.15 1.59 1.1288 5 1 2 8 86.25 1.51 1.1278 4 2 4 8 86.41 1.58 1.1261 3 1 6 8 88.99 3.04 1.1000 5 2 1 8 89.06 3.96 1.0993 5 0 3 8 89.06 3.36 1.0993 4 3 3 8 89.19 7.75 1.0981 4 1 5 8 89.38 3.51 1.0962 2 1 7 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.