beta-Cu7PSe6 Gaudin E, Boucher F, Petricek V, Taulelle F, Evain M Acta Crystallographica B56 (2000) 402-408 Structures and phase transitions of the A7PSe6 (A = Ag, Cu) argyrodite-type ionic conductors. II. beta- and gamma-Cu7PSe6 Note: T = 293 K _database_code_amcsd 0009919 CELL PARAMETERS: 10.1080 10.1080 10.1080 90.000 90.000 90.000 SPACE GROUP: P2_13 X-RAY WAVELENGTH: 1.541838 Cell Volume: 1032.751 Density (g/cm3): 6.106 MAX. ABS. INTENSITY / VOLUME**2: 77.67163139 RIR: 4.142 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.18 3.23 5.8359 1 1 1 4 19.64 1.43 4.5204 2 1 0 12 24.92 8.05 3.5737 2 2 0 12 26.45 7.90 3.3693 2 2 1 12 27.91 1.31 3.1964 3 0 1 12 27.91 2.47 3.1964 3 1 0 12 29.30 44.69 3.0477 3 1 1 12 30.64 100.00 2.9179 2 2 2 4 31.92 9.18 2.8035 3 0 2 12 31.92 1.12 2.8035 3 2 0 12 33.16 3.33 2.7015 3 2 1 12 33.16 13.26 2.7015 3 1 2 12 37.76 11.99 2.3825 4 1 1 12 38.83 4.81 2.3189 3 3 1 12 39.89 2.18 2.2602 4 2 0 12 40.91 1.63 2.2057 4 2 1 12 40.91 6.32 2.2057 4 1 2 12 41.92 4.79 2.1550 3 3 2 12 43.88 15.90 2.0633 4 2 2 12 44.83 1.32 2.0216 4 0 3 12 44.83 2.13 2.0216 4 3 0 12 45.77 1.04 1.9823 5 1 0 12 45.77 2.20 1.9823 4 1 3 12 45.77 1.86 1.9823 5 0 1 12 46.69 18.26 1.9453 3 3 3 4 46.69 39.13 1.9453 5 1 1 12 48.50 1.39 1.8770 4 2 3 12 48.50 2.02 1.8770 5 0 2 12 49.38 3.02 1.8455 5 1 2 12 51.12 45.77 1.7869 4 4 0 12 51.97 1.15 1.7596 5 2 2 12 52.81 2.41 1.7335 5 0 3 12 53.64 4.87 1.7086 5 3 1 12 53.64 2.60 1.7086 5 1 3 12 54.47 1.44 1.6847 6 0 0 6 57.68 1.99 1.5982 6 0 2 12 57.68 2.05 1.5982 6 2 0 12 60.02 7.21 1.5415 5 3 3 12 60.78 14.33 1.5238 6 2 2 12 62.30 1.64 1.4903 6 3 1 12 65.27 1.15 1.4295 5 4 3 12 66.00 1.79 1.4154 7 1 1 12 69.60 1.36 1.3507 6 2 4 12 71.72 3.39 1.3159 7 3 1 12 71.72 2.94 1.3159 7 1 3 12 71.72 4.25 1.3159 5 5 3 12 75.20 4.46 1.2635 8 0 0 6 80.66 1.77 1.1912 8 2 2 12 80.66 2.22 1.1912 6 6 0 12 82.68 3.15 1.1672 7 5 1 12 82.68 3.22 1.1672 7 1 5 12 82.68 2.06 1.1672 5 5 5 4 83.35 6.29 1.1595 6 6 2 12 88.03 1.30 1.1095 7 5 3 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.