La Mn O3 Rodriguez-Carvajal J, Hennion M, Moussa F, Moudden A, Pinsard L, Revcolevschi A Physical Review B - Condensed Matter 57 (1998) 3189-3192 Neutron-diffraction of the Jahn-Teller transition in stoichiometric LaMnO3 _cod_database_code 1006142 _database_code_amcsd 0015290 CELL PARAMETERS: 5.5520 5.7269 7.7365 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 245.988 Density (g/cm3): 6.529 MAX. ABS. INTENSITY / VOLUME**2: 192.6680858 RIR: 9.608 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 22.30 11.43 3.9863 1 1 0 4 22.99 6.42 3.8682 0 0 2 2 25.13 7.39 3.5435 1 1 1 8 31.24 19.95 2.8635 0 2 0 2 32.25 80.11 2.7760 1 1 2 8 32.25 19.89 2.7760 2 0 0 2 33.37 5.04 2.6854 0 2 1 4 37.85 1.01 2.3772 2 1 1 8 39.14 7.07 2.3015 0 2 2 4 39.98 9.44 2.2553 2 0 2 4 41.71 2.14 2.1652 1 1 3 8 45.51 20.23 1.9931 2 2 0 4 46.98 11.09 1.9341 0 0 4 2 47.08 4.67 1.9301 2 2 1 8 47.44 2.78 1.9163 0 2 3 4 51.58 1.25 1.7718 2 2 2 8 51.92 1.20 1.7610 3 1 0 4 52.02 6.48 1.7580 1 3 1 8 52.59 2.00 1.7401 1 1 4 8 56.23 8.96 1.6359 1 3 2 8 57.50 6.45 1.6028 0 2 4 4 57.50 15.05 1.6027 3 1 2 8 58.13 7.06 1.5869 2 0 4 4 58.53 1.37 1.5770 2 2 3 8 62.84 3.16 1.4789 1 3 3 8 65.16 1.27 1.4317 0 4 0 2 66.40 1.93 1.4078 0 4 1 4 67.48 8.83 1.3880 2 2 4 8 67.48 2.64 1.3880 4 0 0 2 72.13 1.83 1.3096 3 3 1 8 74.58 1.20 1.2725 2 4 0 4 75.68 2.99 1.2567 3 3 2 8 75.76 2.02 1.2556 2 4 1 8 76.23 1.79 1.2490 4 2 0 4 77.86 4.49 1.2268 1 1 6 8 78.21 1.00 1.2222 2 2 5 8 81.49 1.34 1.1812 3 3 3 8 82.02 1.33 1.1748 1 3 5 8 85.00 1.95 1.1411 2 4 3 8 86.26 2.10 1.1277 4 0 4 4 87.96 1.85 1.1101 1 5 1 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.