Hardystonite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from the powder pattern of R040026 Louisnathan S J Zeitschrift fur Kristallographie 130 (1969) 427-437 Refinement of the crystal structure of hardystonite, Ca2ZnSi2O7 Locality: Franklin, New Jersey, USA CELL PARAMETERS: 7.8277 7.8277 5.0180 90.000 90.000 90.000 SPACE GROUP: P-42_1m ATOM X Y Z OCCUPANCY ISO(B) Ca 0.33220 0.16780 0.50610 1.000 1.154 Zn 0.00000 0.00000 0.00000 1.000 0.654 Si 0.13930 0.36070 0.93940 1.000 0.468 O 0.50000 0.00000 0.17710 1.000 1.749 O 0.14000 0.36000 0.25510 1.000 1.130 O 0.08180 0.18850 0.78470 1.000 1.740 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 7 +/- 7 +/- 4 MAX. ABS. INTENSITY / VOLUME**2: 22.78263453 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 16.01 2.47 5.5350 1 1 0 17.67 18.70 5.0180 0 0 1 21.03 6.57 4.2245 1 0 1 22.72 2.10 3.9139 2 0 0 23.94 45.79 3.7176 1 1 1 25.44 4.22 3.5007 2 1 0 28.93 66.96 3.0861 2 0 1 31.15 100.00 2.8711 2 1 1 32.35 15.67 2.7675 2 2 0 35.79 6.89 2.5090 0 0 2 36.29 42.73 2.4753 3 1 0 37.10 13.15 2.4234 2 2 1 37.65 6.12 2.3893 1 0 2 38.90 6.99 2.3150 3 0 1 39.43 5.61 2.2852 1 1 2 40.64 11.09 2.2199 3 1 1 42.81 1.10 2.1122 2 0 2 44.42 12.54 2.0393 2 1 2 45.52 2.32 1.9925 3 2 1 46.40 1.41 1.9569 4 0 0 47.92 6.65 1.8985 4 1 0 49.01 12.62 1.8588 2 2 2 49.40 4.29 1.8450 3 3 0 50.03 4.31 1.8232 4 0 1 51.46 9.52 1.7757 4 1 1 51.89 40.87 1.7621 3 1 2 52.26 15.05 1.7503 4 2 0 52.87 9.98 1.7317 3 3 1 55.61 7.25 1.6527 4 2 1 56.01 2.47 1.6417 3 2 2 57.56 5.27 1.6012 1 1 3 60.16 5.33 1.5381 2 0 3 60.29 2.71 1.5351 5 1 0 61.43 5.24 1.5092 2 1 3 63.36 9.62 1.4680 5 1 1 64.96 5.42 1.4355 4 2 2 65.17 5.85 1.4315 2 2 3 66.39 2.53 1.4082 3 0 3 67.03 9.30 1.3962 5 2 1 67.59 4.13 1.3859 3 1 3 67.71 5.61 1.3838 4 4 0 70.10 2.94 1.3424 5 3 0 70.61 4.30 1.3340 4 4 1 70.96 1.35 1.3282 4 3 2 72.13 2.10 1.3095 5 1 2 72.44 5.54 1.3046 6 0 0 73.61 1.17 1.2869 6 1 0 74.65 1.55 1.2715 4 0 3 75.60 1.17 1.2577 5 2 2 75.80 4.54 1.2550 4 1 3 75.83 2.40 1.2545 0 0 4 76.94 4.62 1.2392 3 3 3 79.02 2.37 1.2117 4 4 2 79.21 1.50 1.2093 4 2 3 79.81 5.58 1.2017 6 2 1 80.94 2.40 1.1877 5 4 1 81.28 3.94 1.1837 5 3 2 83.52 4.51 1.1575 6 0 2 84.83 1.54 1.1430 4 3 3 84.86 1.94 1.1426 2 2 4 85.94 5.06 1.1310 5 1 3 85.98 1.28 1.1306 3 0 4 87.09 4.33 1.1190 3 1 4 89.28 1.56 1.0972 5 2 3 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.