Armalcolite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R070260 Wechsler B A American Mineralogist 62 (1977) 913-920 Cation distribution and high-temperature crystal chemistry of armalcolite sample Arm-E, T = 24 deg C, before annealing CELL PARAMETERS: 9.7300 10.0320 3.7350 90.000 90.000 90.000 SPACE GROUP: Bbmm ATOM X Y Z OCCUPANCY ISO(B) Fe 0.80743 0.25000 0.00000 0.332 0.747 Mg 0.80743 0.25000 0.00000 0.332 0.747 Ti 0.80743 0.25000 0.00000 0.335 0.747 Fe 0.13464 0.43528 0.00000 0.084 0.711 Mg 0.13464 0.43528 0.00000 0.084 0.711 Ti 0.13464 0.43528 0.00000 0.832 0.711 O 0.22430 0.25000 0.00000 1.000 1.212 O 0.04640 0.88460 0.00000 1.000 1.086 O 0.31330 0.93480 0.00000 1.000 0.998 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 8 +/- 9 +/- 3 MAX. ABS. INTENSITY / VOLUME**2: 25.07477314 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 17.68 12.47 5.0160 0 2 0 18.24 37.62 4.8650 2 0 0 20.29 1.99 4.3774 2 1 0 25.51 8.16 3.4922 2 2 0 25.55 100.00 3.4869 1 0 1 27.07 4.25 3.2936 1 1 1 31.24 4.22 2.8631 1 2 1 32.49 71.38 2.7558 2 3 0 36.70 18.44 2.4489 3 0 1 36.95 6.24 2.4325 4 0 0 37.26 20.51 2.4135 1 3 1 37.82 1.61 2.3790 3 1 1 40.46 13.48 2.2292 2 4 0 41.01 1.31 2.2006 3 2 1 41.25 15.52 2.1887 4 2 0 45.93 3.94 1.9758 3 3 1 46.15 19.79 1.9671 4 3 0 48.76 31.83 1.8675 0 0 2 49.12 9.91 1.8548 2 5 0 52.21 8.45 1.7522 3 4 1 52.49 3.25 1.7435 2 0 2 53.91 1.43 1.7008 5 1 1 54.91 12.23 1.6720 0 6 0 55.83 1.39 1.6468 2 2 2 56.38 17.07 1.6319 5 2 1 56.77 1.79 1.6217 6 0 0 57.57 3.91 1.6009 6 1 0 58.36 2.87 1.5812 2 6 0 59.57 7.84 1.5520 3 5 1 59.82 19.11 1.5460 2 3 2 60.36 15.70 1.5336 5 3 1 61.51 5.39 1.5076 1 6 1 62.72 2.37 1.4813 4 0 2 63.79 1.94 1.4591 6 3 0 65.17 4.25 1.4315 2 4 2 65.67 2.82 1.4217 5 4 1 65.73 5.78 1.4206 4 2 2 67.88 5.38 1.3808 3 6 1 68.04 1.07 1.3779 4 6 0 68.22 2.11 1.3747 2 7 0 69.39 8.17 1.3544 4 3 2 71.12 1.82 1.3255 1 7 1 71.72 4.51 1.3160 2 5 2 73.27 4.06 1.2919 7 1 1 75.36 1.81 1.2612 6 5 0 75.38 6.06 1.2609 7 2 1 76.47 6.83 1.2457 0 6 2 77.26 2.36 1.2349 1 0 3 78.04 1.11 1.2244 6 0 2 78.73 2.54 1.2154 6 1 2 79.41 1.75 1.2068 2 6 2 81.42 1.39 1.1820 8 2 0 83.10 1.50 1.1623 3 0 3 83.44 2.03 1.1585 1 3 3 84.21 1.40 1.1498 6 3 2 87.52 2.37 1.1146 4 8 0 88.27 1.73 1.1071 2 7 2 89.75 2.24 1.0926 7 5 1 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.