Cs2 Cu N6 O12 Pb Klein S, Reinen D Journal of Solid State Chemistry 25 (1978) 295-299 The structure of the high temperature alpha modification of Cs2PbCu(NO2)6 and the Jahn-Teller induced alpha-beta phase transition - a neutron diffraction study _cod_database_code 1008029 _database_code_amcsd 0015976 CELL PARAMETERS: 10.9700 10.9700 10.9700 90.000 90.000 90.000 SPACE GROUP: Fm3 X-RAY WAVELENGTH: 1.541838 Cell Volume: 1320.140 Density (g/cm3): 4.088 MAX. ABS. INTENSITY / VOLUME**2: 137.9685859 RIR: 10.990 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.98 13.33 6.3335 1 1 1 8 16.16 3.23 5.4850 2 0 0 6 22.93 100.00 3.8785 2 2 0 12 26.96 10.90 3.3076 3 1 1 24 28.18 3.57 3.1668 2 2 2 8 32.65 46.58 2.7425 4 0 0 6 35.68 7.95 2.5167 3 3 1 24 36.63 3.79 2.4530 4 2 0 12 40.28 64.93 2.2392 4 2 2 24 42.83 2.04 2.1112 5 1 1 24 42.83 2.56 2.1112 3 3 3 8 46.85 19.74 1.9392 4 4 0 12 49.13 2.56 1.8543 5 3 1 24 49.13 1.18 1.8543 5 1 3 24 52.78 8.15 1.7345 6 0 2 12 52.78 14.57 1.7345 6 2 0 12 54.88 2.00 1.6729 5 3 3 24 58.27 4.06 1.5834 4 4 4 8 63.46 19.20 1.4659 6 2 4 24 63.46 12.56 1.4659 6 4 2 24 65.34 1.07 1.4282 7 1 3 24 68.42 4.05 1.3713 8 0 0 6 70.23 1.33 1.3402 7 3 3 24 73.21 6.60 1.2928 8 2 2 24 73.21 4.04 1.2928 6 6 0 12 77.89 3.70 1.2265 8 4 0 12 77.89 3.85 1.2265 8 0 4 12 82.48 6.91 1.1694 6 6 4 24 87.03 3.87 1.1196 8 4 4 24 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.