H2 Li2 O5 S Smith H, Peterson S, Levy H Journal of Chemical Physics 48 (1968) 5561-5565 Neutron-diffraction study of lithium sulfate monohydrate _cod_database_code 1008190 _database_code_amcsd 0016127 CELL PARAMETERS: 5.4537 4.8570 8.1734 90.000 107.367 90.000 SPACE GROUP: P2_1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 206.632 Density (g/cm3): 2.056 MAX. ABS. INTENSITY / VOLUME**2: 5.484936781 RIR: 0.869 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.34 11.09 7.8008 0 0 1 2 17.03 17.23 5.2051 1 0 0 2 17.43 85.79 5.0872 -1 0 1 2 21.55 100.00 4.1231 0 1 1 2 22.80 25.96 3.9004 0 0 2 2 23.20 84.41 3.8335 1 0 1 2 24.08 27.81 3.6952 -1 0 2 2 25.08 91.35 3.5511 1 1 0 2 25.35 4.57 3.5130 -1 1 1 2 29.37 56.47 3.0412 0 1 2 2 29.69 6.27 3.0092 1 1 1 2 30.39 48.45 2.9408 -1 1 2 2 32.54 13.03 2.7519 1 0 2 2 32.87 42.60 2.7250 -2 0 1 2 33.62 14.67 2.6659 -1 0 3 2 34.49 4.65 2.6003 0 0 3 2 35.29 4.31 2.5436 -2 0 2 2 37.02 34.53 2.4285 0 2 0 1 37.57 7.24 2.3943 1 1 2 2 37.86 4.44 2.3765 -2 1 1 2 38.52 11.92 2.3370 -1 1 3 2 38.84 2.48 2.3187 0 2 1 2 39.27 2.43 2.2940 2 1 0 2 39.30 13.73 2.2924 0 1 3 2 39.64 3.76 2.2734 2 0 1 2 40.01 5.14 2.2533 -2 1 2 2 41.01 6.05 2.2008 1 2 0 2 41.19 7.38 2.1916 -1 2 1 2 43.92 1.08 2.0616 0 2 2 2 43.98 7.26 2.0590 2 1 1 2 44.15 3.45 2.0515 1 2 1 2 44.48 3.57 2.0369 -1 0 4 2 44.65 2.02 2.0294 -1 2 2 2 45.32 3.14 2.0011 -2 1 3 2 47.35 9.30 1.9199 1 1 3 2 47.43 1.87 1.9168 2 0 2 2 49.32 2.85 1.8476 -2 0 4 2 50.10 2.99 1.8209 1 2 2 2 50.33 3.31 1.8130 -2 2 1 2 50.43 2.13 1.8098 0 1 4 2 50.81 1.16 1.7969 -3 0 2 2 50.86 4.28 1.7953 -1 2 3 2 51.24 1.48 1.7829 2 1 2 2 51.47 1.46 1.7756 2 2 0 2 52.07 1.71 1.7565 -2 2 2 2 52.76 5.42 1.7350 3 0 0 2 53.03 3.77 1.7269 -2 1 4 2 54.01 7.23 1.6978 -3 1 1 2 55.36 1.12 1.6597 2 2 1 2 56.31 2.86 1.6339 3 1 0 2 57.05 1.05 1.6143 2 0 3 2 57.57 4.16 1.6010 -3 1 3 2 57.78 2.41 1.5957 3 0 1 2 58.20 5.65 1.5852 0 3 1 2 58.24 2.90 1.5842 1 2 3 2 58.45 2.82 1.5791 1 1 4 2 59.21 1.95 1.5606 -1 2 4 2 59.22 7.26 1.5602 0 0 5 2 59.68 4.32 1.5493 -1 1 5 2 59.82 3.60 1.5459 1 3 0 2 59.85 4.14 1.5454 -3 0 4 2 60.43 1.42 1.5319 2 1 3 2 62.07 3.37 1.4953 0 3 2 2 62.58 1.38 1.4844 -2 1 5 2 62.65 3.69 1.4829 -1 3 2 2 63.13 1.22 1.4727 -3 1 4 2 63.24 1.86 1.4704 -2 2 4 2 64.12 2.46 1.4524 -3 2 1 2 65.03 1.50 1.4342 3 0 2 2 66.20 1.24 1.4117 3 2 0 2 67.07 2.77 1.3954 1 3 2 2 67.27 2.24 1.3919 -2 3 1 2 67.71 3.93 1.3838 -1 3 3 2 68.15 2.68 1.3760 2 0 4 2 68.18 4.06 1.3755 3 1 2 2 68.22 1.01 1.3747 2 3 0 2 68.24 5.65 1.3744 0 3 3 2 68.73 1.85 1.3658 -2 3 2 2 69.04 2.61 1.3605 -1 0 6 2 70.61 3.46 1.3339 -4 0 3 2 70.63 2.41 1.3336 3 2 1 2 70.67 1.42 1.3330 -2 0 6 2 71.55 2.75 1.3188 2 3 1 2 71.93 3.12 1.3126 0 2 5 2 71.98 1.73 1.3119 -4 1 2 2 72.50 1.57 1.3038 -3 2 4 2 73.70 1.33 1.2854 -2 1 6 2 74.21 1.79 1.2778 3 0 3 2 76.47 1.61 1.2457 0 3 4 2 77.60 2.32 1.2303 -4 1 4 2 78.56 2.59 1.2176 -2 3 4 2 79.36 2.64 1.2073 -3 3 1 2 80.18 1.16 1.1972 2 2 4 2 80.44 1.22 1.1939 -3 1 6 2 81.01 1.39 1.1869 -1 2 6 2 82.35 1.32 1.1710 -3 3 3 2 82.51 1.90 1.1691 -4 2 3 2 83.87 1.43 1.1536 -1 4 2 2 84.16 1.87 1.1503 -1 3 5 2 85.41 1.10 1.1367 4 0 2 2 85.93 2.40 1.1311 -1 1 7 2 85.96 1.29 1.1308 3 2 3 2 88.14 2.38 1.1084 3 1 4 2 88.95 1.23 1.1004 2 4 0 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.