Lawsonite Kolesov B A, Lager G A, Schultz A J European Journal of Mineralogy 20 (2008) 63-72 Behaviour of H2O and OH in lawsonite: a single-crystal neutron diffraction and Raman spectroscopic investigation Sample: T = 295 K _database_code_amcsd 0007253 CELL PARAMETERS: 5.8500 8.7900 13.1220 90.000 90.000 90.000 SPACE GROUP: Cmcm X-RAY WAVELENGTH: 1.541838 Cell Volume: 674.753 Density (g/cm3): 3.093 MAX. ABS. INTENSITY / VOLUME**2: 5.934156423 RIR: 0.625 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.50 32.15 6.5610 0 0 2 2 18.22 55.48 4.8700 1 1 0 4 19.44 20.92 4.5657 1 1 1 8 21.32 30.92 4.1675 0 2 1 4 22.74 2.49 3.9105 1 1 2 8 24.38 53.53 3.6515 0 2 2 4 27.18 1.42 3.2805 0 0 4 2 27.41 26.96 3.2542 1 1 3 8 30.56 29.40 2.9250 2 0 0 2 32.92 100.00 2.7208 1 1 4 8 33.54 48.19 2.6715 2 0 2 4 34.10 78.30 2.6289 0 2 4 4 34.23 64.55 2.6198 1 3 0 4 34.92 3.96 2.5691 1 3 1 8 36.91 38.99 2.4350 2 2 0 4 36.95 35.99 2.4330 1 3 2 8 37.57 17.48 2.3942 2 2 1 8 38.99 10.81 2.3103 1 1 5 8 39.47 16.80 2.2829 2 2 2 8 40.01 30.54 2.2532 0 2 5 4 40.12 1.58 2.2475 1 3 3 8 41.07 3.75 2.1975 0 4 0 2 41.28 4.20 2.1870 0 0 6 2 41.36 2.95 2.1832 2 0 4 4 41.67 1.91 2.1673 0 4 1 4 42.49 65.49 2.1276 2 2 3 8 43.43 2.38 2.0837 0 4 2 4 44.25 2.35 2.0471 1 3 4 8 45.46 2.09 1.9951 1 1 6 8 46.23 18.13 1.9636 0 4 3 4 46.37 2.16 1.9580 0 2 6 4 48.31 5.65 1.8840 3 1 1 8 49.14 1.31 1.8541 1 3 5 8 49.95 1.22 1.8257 0 4 4 4 51.17 2.12 1.7850 2 2 5 8 52.05 1.58 1.7569 2 4 0 4 52.23 21.50 1.7515 2 0 6 4 52.29 3.94 1.7494 1 1 7 8 52.55 2.60 1.7414 2 4 1 8 53.12 15.89 1.7243 0 2 7 4 54.03 12.53 1.6971 2 4 2 8 54.46 5.21 1.6848 0 4 5 4 54.50 1.37 1.6836 1 5 0 4 54.67 1.30 1.6789 1 3 6 8 54.99 3.97 1.6699 1 5 1 8 55.84 10.06 1.6466 3 1 4 8 56.07 18.76 1.6402 0 0 8 2 56.44 14.43 1.6303 2 4 3 8 56.56 15.87 1.6271 2 2 6 8 56.70 17.74 1.6233 3 3 0 4 58.58 6.34 1.5758 3 3 2 8 59.46 3.07 1.5545 1 1 8 8 59.65 19.01 1.5501 0 4 6 4 59.70 72.38 1.5488 2 4 4 8 60.04 1.33 1.5410 3 1 5 8 61.95 3.55 1.4979 1 5 4 8 63.62 30.62 1.4625 4 0 0 2 63.75 5.04 1.4600 2 4 5 8 64.94 1.17 1.4359 3 1 6 8 65.26 3.77 1.4298 0 6 2 4 65.44 1.36 1.4262 0 4 7 4 67.36 14.13 1.3902 1 3 8 8 67.71 1.45 1.3838 0 2 9 4 67.92 1.61 1.3800 4 2 1 8 69.04 14.17 1.3604 2 2 8 8 69.20 4.47 1.3577 4 2 2 8 70.38 2.19 1.3377 0 6 4 4 70.50 2.94 1.3357 3 1 7 8 70.60 1.01 1.3341 1 5 6 8 71.82 3.12 1.3145 0 4 8 4 72.11 13.42 1.3099 2 6 0 4 72.37 1.60 1.3057 3 5 0 4 72.52 5.64 1.3034 2 6 1 8 72.79 2.86 1.2993 3 5 1 8 73.76 1.71 1.2845 2 6 2 8 73.94 2.33 1.2819 2 4 7 8 74.20 14.79 1.2780 4 2 4 8 74.48 1.05 1.2740 1 3 9 8 75.63 2.28 1.2574 0 2 10 4 75.81 9.16 1.2548 2 6 3 8 75.97 1.49 1.2526 1 5 7 8 77.87 3.31 1.2267 4 2 5 8 78.60 2.63 1.2172 0 6 6 4 78.65 1.18 1.2165 2 6 4 8 78.91 3.81 1.2131 3 5 4 8 80.03 1.90 1.1990 2 4 8 8 80.17 15.89 1.1972 2 0 10 4 80.18 1.10 1.1971 4 4 2 8 81.41 4.27 1.1821 1 7 3 8 82.15 5.09 1.1733 1 3 10 8 82.18 4.39 1.1729 4 4 3 8 83.32 1.58 1.1598 5 1 0 4 83.42 1.74 1.1587 1 1 11 8 83.73 1.14 1.1551 2 2 10 8 83.85 9.42 1.1538 3 3 8 8 84.08 1.20 1.1513 0 2 11 4 84.20 4.18 1.1499 1 7 4 8 86.36 1.43 1.1266 0 4 10 4 86.89 1.36 1.1210 5 1 3 8 87.45 4.22 1.1153 4 2 7 8 87.77 4.47 1.1121 1 7 5 8 88.54 2.04 1.1044 4 4 5 8 89.12 3.40 1.0987 0 8 0 2 89.66 5.93 1.0934 5 1 4 8 89.86 7.84 1.0916 4 0 8 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.