Nd Ni O3 Garcia-Munoz J, Rodriguez-Carvajal, Lacorre P, Torrance J Physical Review B46 (1992) 4414-4425 Neutron-diffraction study of RNiO3 (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition _cod_database_code 1000318 _database_code_amcsd 0015267 CELL PARAMETERS: 5.3891 5.3816 7.6101 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 220.708 Density (g/cm3): 7.551 MAX. ABS. INTENSITY / VOLUME**2: 222.0341125 RIR: 9.575 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 23.36 11.85 3.8080 1 1 0 4 23.38 6.76 3.8050 0 0 2 2 26.17 4.67 3.4055 1 1 1 8 33.25 25.03 2.6946 2 0 0 2 33.29 100.00 2.6916 1 1 2 8 33.30 23.20 2.6908 0 2 0 2 35.38 3.49 2.5369 0 2 1 4 41.05 9.23 2.1990 2 0 2 4 41.08 8.11 2.1970 0 2 2 4 42.84 1.65 2.1112 1 1 3 8 47.77 24.39 1.9040 2 2 0 4 47.81 13.41 1.9025 0 0 4 2 49.34 3.05 1.8471 2 2 1 8 49.37 1.79 1.8458 0 2 3 4 53.80 1.20 1.7039 3 1 0 4 53.84 1.46 1.7027 2 2 2 8 53.87 2.09 1.7019 1 1 4 8 55.31 4.33 1.6610 1 3 1 8 59.44 17.96 1.5551 3 1 2 8 59.48 8.80 1.5542 2 0 4 4 59.50 12.52 1.5537 1 3 2 8 59.51 8.13 1.5534 0 2 4 4 60.83 1.04 1.5228 2 2 3 8 66.11 2.05 1.4134 1 3 3 8 69.81 2.94 1.3473 4 0 0 2 69.90 11.15 1.3458 2 2 4 8 69.92 2.13 1.3454 0 4 0 2 71.17 1.33 1.3249 0 4 1 4 76.01 1.19 1.2520 3 3 1 8 79.57 2.41 1.2047 4 2 0 4 79.62 4.32 1.2041 3 3 2 8 79.65 1.76 1.2037 2 4 0 4 79.68 5.71 1.2034 1 1 6 8 80.85 1.48 1.1889 2 4 1 8 85.55 1.04 1.1352 3 3 3 8 89.04 2.47 1.0995 4 0 4 4 89.14 1.75 1.0985 0 4 4 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.