Wairakite Seryotkin Y V, Joswig W, Bakakin V V, Belitsky I A, Fursenko B A European Journal of Mineralogy 15 (2003) 475-484 High-temperature crystal structure of wairakite Sample: Wai-20, T = 20 C _database_code_amcsd 0006990 CELL PARAMETERS: 13.6660 13.6230 13.5310 90.000 90.500 90.000 SPACE GROUP: I2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 2518.996 Density (g/cm3): 2.291 MAX. ABS. INTENSITY / VOLUME**2: 6.617500855 RIR: 0.941 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.96 28.80 6.8327 2 0 0 2 13.00 25.22 6.8115 0 2 0 2 15.87 32.55 5.5831 -2 1 1 4 15.92 40.87 5.5662 -1 2 1 4 15.95 7.75 5.5553 -1 1 2 4 15.97 38.85 5.5505 2 1 1 4 15.97 36.10 5.5500 1 2 1 4 16.05 9.83 5.5232 1 1 2 4 18.39 38.99 4.8239 2 2 0 4 18.48 4.59 4.8000 0 2 2 4 22.57 1.16 3.9392 -2 2 2 4 24.35 2.34 3.6548 -3 1 2 4 24.46 6.68 3.6391 -1 3 2 4 24.52 9.17 3.6301 1 3 2 4 24.54 9.95 3.6274 3 1 2 4 24.63 2.63 3.6147 2 1 3 4 26.08 51.22 3.4164 4 0 0 2 26.17 58.91 3.4058 0 4 0 2 26.35 100.00 3.3826 0 0 4 2 27.74 1.43 3.2160 3 3 0 4 29.18 5.03 3.0603 -4 0 2 2 29.36 2.71 3.0420 -2 0 4 2 29.36 2.18 3.0420 0 4 2 4 29.57 1.54 3.0210 2 0 4 2 30.71 24.87 2.9115 -3 3 2 4 30.72 17.74 2.9104 -3 2 3 4 30.78 11.92 2.9049 -2 3 3 4 30.86 18.97 2.8976 3 3 2 4 30.93 16.97 2.8911 2 3 3 4 30.95 12.01 2.8897 3 2 3 4 32.16 1.19 2.7831 -2 4 2 4 32.23 3.68 2.7776 -2 2 4 4 32.42 6.78 2.7616 2 2 4 4 33.42 1.78 2.6813 -4 1 3 4 33.44 2.58 2.6797 -4 3 1 4 33.48 2.63 2.6766 -3 4 1 4 33.51 4.15 2.6741 -3 1 4 4 33.53 5.54 2.6725 4 3 1 4 33.55 2.08 2.6712 3 4 1 4 33.59 1.39 2.6684 -1 4 3 4 33.64 1.74 2.6644 -1 3 4 4 33.66 1.42 2.6630 1 4 3 4 33.73 1.95 2.6572 1 3 4 4 33.79 1.43 2.6527 3 1 4 4 35.94 4.02 2.4987 -5 1 2 4 36.12 4.51 2.4866 -1 5 2 4 36.16 7.22 2.4841 5 1 2 4 36.16 6.54 2.4837 1 5 2 4 36.20 4.60 2.4813 -2 1 5 4 36.27 1.35 2.4769 -1 2 5 4 37.28 17.24 2.4120 4 4 0 4 37.47 2.78 2.4000 0 4 4 4 37.58 1.20 2.3933 4 0 4 2 38.44 1.35 2.3417 5 3 0 4 39.61 2.68 2.2756 -4 2 4 4 39.73 1.09 2.2688 -2 4 4 4 39.89 2.02 2.2600 2 4 4 4 40.68 2.16 2.2180 -5 3 2 4 40.77 1.70 2.2130 -3 5 2 4 40.77 2.01 2.2130 6 1 1 4 40.83 1.80 2.2102 -1 6 1 4 40.85 1.60 2.2092 -3 2 5 4 40.85 1.88 2.2092 1 6 1 4 40.87 2.22 2.2078 5 3 2 4 40.89 1.98 2.2069 3 5 2 4 41.11 1.30 2.1957 2 3 5 4 42.21 2.71 2.1408 0 2 6 4 42.88 3.71 2.1093 -5 1 4 4 43.35 1.48 2.0874 4 1 5 4 45.45 1.70 1.9958 1 3 6 4 45.53 3.01 1.9924 3 1 6 4 47.03 1.66 1.9321 -5 3 4 4 47.96 1.11 1.8969 -6 0 4 2 48.06 4.47 1.8932 6 4 0 4 48.12 6.07 1.8910 4 6 0 4 48.28 5.79 1.8852 0 6 4 4 48.37 4.11 1.8816 6 0 4 2 48.41 2.67 1.8803 0 4 6 4 48.90 1.86 1.8624 -7 1 2 4 48.94 1.96 1.8610 -6 3 3 4 49.10 2.24 1.8554 -3 6 3 4 49.20 3.75 1.8518 -3 3 6 4 49.25 1.48 1.8502 6 3 3 4 49.25 1.62 1.8500 3 6 3 4 49.51 2.76 1.8411 3 3 6 4 49.58 1.16 1.8387 2 1 7 4 50.13 1.06 1.8198 6 4 2 4 50.23 1.65 1.8163 -2 4 6 4 52.67 1.69 1.7378 -7 2 3 4 52.87 1.65 1.7316 -3 7 2 4 52.92 3.78 1.7302 -2 7 3 4 53.01 5.46 1.7275 7 2 3 4 53.02 4.71 1.7273 2 7 3 4 53.04 5.33 1.7267 -3 2 7 4 53.10 1.29 1.7248 -1 5 6 4 53.11 2.17 1.7245 -2 3 7 4 53.19 1.82 1.7219 1 5 6 4 53.32 2.29 1.7182 5 1 6 4 53.33 3.22 1.7178 2 3 7 4 53.37 1.48 1.7165 3 2 7 4 53.66 2.04 1.7082 8 0 0 2 53.84 3.68 1.7029 0 8 0 2 54.23 2.70 1.6913 0 0 8 2 54.55 1.90 1.6821 -7 4 1 4 54.73 1.98 1.6771 4 7 1 4 54.80 1.54 1.6751 -1 7 4 4 54.92 1.20 1.6717 7 1 4 4 55.09 1.24 1.6669 1 4 7 4 55.36 2.25 1.6596 -8 0 2 2 55.46 1.31 1.6569 8 2 0 4 55.62 2.07 1.6523 2 8 0 4 57.12 1.10 1.6125 -8 2 2 4 57.30 3.93 1.6080 6 6 0 4 57.89 1.29 1.5930 2 2 8 4 57.96 1.24 1.5911 -8 1 3 4 58.16 1.77 1.5863 8 3 1 4 58.27 1.26 1.5835 3 8 1 4 58.33 1.35 1.5818 1 8 3 4 58.80 1.01 1.5705 3 1 8 4 60.91 1.11 1.5210 0 8 4 4 62.64 1.19 1.4830 8 2 4 4 63.08 1.27 1.4737 -7 1 6 4 63.47 1.29 1.4657 -1 7 6 4 63.62 1.84 1.4625 -2 1 9 4 66.24 1.21 1.4108 -9 3 2 4 66.38 1.07 1.4082 -6 7 3 4 66.51 1.23 1.4059 -3 9 2 4 66.59 1.83 1.4043 3 9 2 4 66.62 1.10 1.4037 7 6 3 4 66.65 1.07 1.4033 -3 6 7 4 68.64 1.22 1.3674 -8 0 6 2 69.27 1.46 1.3564 0 6 8 4 69.52 1.53 1.3522 6 0 8 2 69.52 2.31 1.3522 -7 7 2 4 69.54 2.08 1.3517 10 1 1 4 69.71 1.39 1.3489 7 7 2 4 69.87 1.68 1.3462 -2 7 7 4 70.06 2.23 1.3430 2 7 7 4 70.18 3.46 1.3411 -1 1 10 4 70.19 2.00 1.3408 7 2 7 4 72.42 1.31 1.3050 -10 1 3 4 72.65 1.10 1.3015 10 3 1 4 72.78 1.09 1.2995 -3 10 1 4 74.07 1.11 1.2799 -8 1 7 4 74.19 2.01 1.2782 -7 8 1 4 74.25 1.48 1.2773 8 7 1 4 74.64 1.96 1.2715 1 8 7 4 75.48 1.21 1.2596 -10 3 3 4 78.71 1.10 1.2157 10 5 1 4 79.00 1.05 1.2120 -5 1 10 4 79.15 1.14 1.2100 3 9 6 4 87.87 1.23 1.1111 -5 5 10 4 88.52 1.10 1.1046 5 5 10 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.