Ca2 Nd O6 Ru Battle P, Jones C, Studer F Journal of Solid State Chemistry 90 (1991) 302-312 The crystal and magnetic structures of Ca2NdRuO6, Ca2HoRuO6 and Sr2ErRuO6 _cod_database_code 1001475 _database_code_amcsd 0013701 CELL PARAMETERS: 5.5439 5.8282 7.9931 90.000 90.060 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 258.265 Density (g/cm3): 5.419 MAX. ABS. INTENSITY / VOLUME**2: 55.01191596 RIR: 3.306 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.84 28.34 4.7093 0 1 1 4 19.48 15.89 4.5577 -1 0 1 2 19.50 4.71 4.5532 1 0 1 2 24.80 10.64 3.5902 -1 1 1 4 24.81 10.79 3.5881 1 1 1 4 30.68 42.33 2.9141 0 2 0 2 31.57 100.00 2.8342 -1 1 2 4 31.59 99.73 2.8321 1 1 2 4 32.30 45.45 2.7719 2 0 0 2 32.71 9.64 2.7378 0 2 1 4 35.87 1.16 2.5032 2 1 0 4 36.61 4.30 2.4544 1 2 1 4 37.10 1.34 2.4232 0 1 3 4 37.43 5.74 2.4024 -1 0 3 2 37.67 11.81 2.3882 2 1 1 4 38.22 1.55 2.3546 0 2 2 4 39.55 1.64 2.2788 -2 0 2 2 39.59 1.72 2.2766 2 0 2 2 40.62 6.36 2.2211 -1 1 3 4 40.65 4.11 2.2196 1 1 3 4 41.68 2.10 2.1668 1 2 2 4 45.14 39.53 2.0084 2 2 0 4 45.39 25.78 1.9983 0 0 4 2 46.16 7.61 1.9664 0 2 3 4 46.62 6.06 1.9482 -2 2 1 4 46.64 6.61 1.9475 2 2 1 4 48.21 1.01 1.8878 0 3 1 4 49.18 3.25 1.8528 1 2 3 4 49.73 2.94 1.8334 1 3 0 4 49.97 2.50 1.8252 -2 1 3 4 51.11 8.45 1.7871 -1 3 1 4 51.12 10.84 1.7869 1 3 1 4 53.24 2.15 1.7206 -3 1 1 4 55.10 8.88 1.6667 -1 3 2 4 55.12 10.40 1.6662 1 3 2 4 55.78 17.00 1.6480 0 2 4 4 56.76 11.40 1.6218 -2 0 4 2 56.83 7.86 1.6202 2 0 4 2 57.12 18.62 1.6125 -3 1 2 4 57.17 20.62 1.6113 3 1 2 4 57.44 1.68 1.6044 -2 2 3 4 57.48 1.77 1.6032 2 2 3 4 59.23 1.75 1.5601 2 3 1 4 60.01 1.75 1.5417 0 1 5 4 60.43 1.44 1.5320 -3 2 1 4 61.05 1.39 1.5177 3 0 3 2 61.37 4.46 1.5106 -1 3 3 4 61.39 3.51 1.5101 1 3 3 4 63.89 1.77 1.4570 0 4 0 2 65.07 3.33 1.4334 0 4 1 4 65.91 8.27 1.4171 -2 2 4 4 65.97 8.21 1.4160 2 2 4 4 67.59 4.19 1.3860 4 0 0 2 68.55 1.79 1.3689 0 4 2 4 68.70 1.35 1.3663 -2 3 3 4 69.84 2.06 1.3467 2 1 5 4 70.89 1.76 1.3294 4 1 1 4 71.42 1.55 1.3207 -3 3 1 4 71.44 1.47 1.3204 3 3 1 4 73.42 1.61 1.2897 2 4 0 4 74.18 1.01 1.2784 0 4 3 4 74.52 1.69 1.2734 -2 4 1 4 74.53 1.93 1.2732 2 4 1 4 74.76 3.01 1.2699 -3 3 2 4 74.80 2.53 1.2693 3 3 2 4 75.11 6.02 1.2647 -1 1 6 4 75.15 6.07 1.2642 1 1 6 4 76.04 3.90 1.2516 4 2 0 4 76.07 1.14 1.2512 -2 2 5 4 76.13 1.46 1.2503 2 2 5 4 77.12 1.11 1.2367 -4 2 1 4 77.81 1.30 1.2276 -2 4 2 4 79.54 2.28 1.2051 -1 3 5 4 79.57 1.50 1.2047 1 3 5 4 79.66 1.29 1.2036 -4 1 3 4 80.21 1.77 1.1967 -3 3 3 4 80.27 1.32 1.1960 3 3 3 4 81.81 1.22 1.1773 0 4 4 4 83.21 1.76 1.1611 -2 4 3 4 83.24 2.03 1.1607 2 4 3 4 85.04 1.70 1.1407 1 5 0 4 85.16 2.07 1.1394 -4 0 4 2 85.26 1.85 1.1383 4 0 4 2 86.10 1.95 1.1293 -1 5 1 4 86.11 1.07 1.1292 1 5 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.