NaV3(SO4)2(OD)6 Grohol D, Huang Qingzhen, Toby B H, Lynn J W, Lee Y S, Nocera D G Physical Review B68 (2003) 0944041-0944047 Powder neutron diffraction analysis and magnetic structure of kagome-type vanadium jarosite NaV3(OD)6(SO4)2 Sample: T = 217 K _database_code_amcsd 0015270 CELL PARAMETERS: 7.2779 7.2779 16.8301 90.000 90.000 120.000 SPACE GROUP: R-3m X-RAY WAVELENGTH: 1.541838 Cell Volume: 772.020 Density (g/cm3): 3.032 MAX. ABS. INTENSITY / VOLUME**2: 16.57851351 RIR: 1.780 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.01 13.70 5.9025 1 0 1 6 15.80 22.05 5.6100 0 0 3 2 17.58 83.13 5.0447 0 1 2 6 24.46 10.63 3.6389 1 1 0 6 25.45 7.15 3.4994 1 0 4 6 28.82 83.61 3.0976 0 2 1 6 29.25 100.00 3.0529 1 1 3 12 30.10 4.48 2.9691 0 1 5 6 30.28 5.32 2.9513 2 0 2 6 31.90 15.43 2.8050 0 0 6 2 35.59 16.61 2.5224 0 2 4 6 39.16 1.09 2.3005 2 0 5 6 39.31 1.57 2.2922 1 2 2 12 40.14 33.04 2.2464 1 0 7 6 45.45 1.16 1.9955 0 1 8 6 46.14 31.57 1.9675 0 3 3 6 47.57 11.53 1.9115 0 2 7 6 48.69 5.14 1.8700 0 0 9 2 50.14 32.48 1.8195 2 2 0 6 52.28 3.93 1.7497 2 0 8 6 52.90 5.13 1.7307 2 2 3 12 53.54 5.78 1.7116 3 1 2 12 54.20 1.65 1.6922 2 1 7 12 55.23 1.29 1.6632 1 1 9 12 57.05 5.32 1.6143 1 3 4 12 58.53 7.32 1.5769 1 2 8 12 58.86 4.57 1.5688 4 0 1 6 59.59 3.37 1.5514 3 1 5 12 59.70 5.14 1.5488 0 4 2 6 60.67 13.70 1.5265 2 2 6 12 62.57 19.18 1.4846 0 2 10 6 62.99 4.96 1.4756 4 0 4 6 64.70 1.05 1.4407 3 2 1 12 65.40 2.97 1.4271 0 4 5 6 65.50 3.97 1.4251 2 3 2 12 66.08 1.89 1.4139 1 3 7 12 67.00 3.10 1.3968 0 3 9 6 68.13 4.20 1.3764 2 0 11 6 68.63 1.62 1.3675 3 2 4 12 70.49 3.01 1.3358 1 4 3 12 70.49 4.64 1.3358 4 1 3 12 71.60 2.65 1.3179 4 0 7 6 72.48 3.13 1.3041 2 2 9 12 74.88 1.16 1.2681 1 0 13 6 76.95 6.04 1.2391 3 2 7 12 78.97 1.28 1.2124 1 3 10 12 80.91 1.23 1.1882 2 4 1 12 84.17 2.61 1.1503 4 0 10 6 85.33 3.16 1.1375 2 1 13 12 86.71 1.83 1.1229 4 2 5 12 87.90 1.52 1.1108 2 2 12 12 89.23 2.71 1.0977 0 4 11 6 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.