K O25 P6 Si2 Ti3 Benmoussa A, Borel M, Grandin A, Leclaire A, Raveau B Acta Crystallographica C47 (1991) 936-938 Structure of mixed-valent titanium silicophosphates, K Ti3 P6 Si2 O25 and Cs Ti3 P6 Si2 O25 _cod_database_code 1001857 _database_code_amcsd 0010252 CELL PARAMETERS: 8.2648 8.2648 17.0380 90.000 90.000 120.000 SPACE GROUP: P-31c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1007.891 Density (g/cm3): 2.717 MAX. ABS. INTENSITY / VOLUME**2: 17.99260323 RIR: 2.156 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.38 35.96 8.5190 0 0 2 2 12.37 13.50 7.1575 1 0 0 6 13.42 15.31 6.5989 1 0 1 12 16.17 2.86 5.4801 1 0 2 12 19.96 5.00 4.4489 1 0 3 12 20.85 11.57 4.2595 0 0 4 2 21.50 34.50 4.1324 1 1 0 6 23.93 60.15 3.7181 1 1 2 6 23.93 39.85 3.7181 2 -1 2 6 24.32 28.22 3.6604 1 0 4 12 25.43 3.72 3.5023 2 0 1 12 29.02 1.22 3.0767 1 0 5 12 29.50 10.45 3.0278 2 0 3 12 30.13 28.64 2.9660 1 1 4 6 30.13 11.47 2.9660 2 -1 4 6 31.50 4.23 2.8397 0 0 6 2 32.68 18.72 2.7400 2 0 4 12 33.54 10.63 2.6718 2 1 1 12 33.54 1.05 2.6718 3 -1 1 12 34.79 6.10 2.5784 3 -1 2 12 36.41 3.65 2.4678 2 0 5 12 36.80 3.34 2.4424 3 -1 3 12 37.70 13.75 2.3858 3 0 0 6 38.09 2.26 2.3628 3 0 1 12 38.46 4.45 2.3404 1 1 6 6 38.46 1.76 2.3404 2 -1 6 6 39.46 1.45 2.2836 2 1 4 12 40.55 1.55 2.2245 2 0 6 12 41.03 6.49 2.1996 3 0 3 12 42.44 2.48 2.1297 0 0 8 2 45.04 1.98 2.0126 2 0 7 12 45.15 2.38 2.0080 2 2 2 6 48.06 2.98 1.8931 2 -1 8 6 49.00 3.94 1.8590 2 2 4 6 49.00 8.46 1.8590 4 -2 4 6 49.93 2.81 1.8267 3 0 6 12 50.44 2.66 1.8094 2 1 7 12 50.44 3.02 1.8094 3 -1 7 12 50.74 1.77 1.7993 4 -1 4 12 50.74 1.70 1.7993 3 1 4 12 51.34 1.79 1.7796 4 0 1 12 53.42 5.47 1.7153 3 1 5 12 54.86 2.81 1.6734 3 -1 8 12 54.96 1.00 1.6707 4 -2 6 6 56.28 1.76 1.6345 5 -2 1 12 56.57 2.24 1.6270 3 1 6 12 58.05 5.77 1.5888 3 0 8 12 58.51 2.40 1.5774 3 2 3 12 58.60 1.56 1.5752 2 -1 10 6 59.15 9.80 1.5619 4 1 0 12 59.61 1.10 1.5511 2 1 9 12 60.15 3.23 1.5384 3 1 7 12 60.15 2.92 1.5384 4 -1 7 12 60.15 3.51 1.5384 2 0 10 12 60.24 1.11 1.5363 4 1 2 12 60.42 1.99 1.5321 5 -2 4 12 62.82 1.10 1.4793 5 -2 5 12 63.43 1.37 1.4664 4 1 4 12 64.65 2.68 1.4417 4 0 7 12 64.65 1.32 1.4417 2 1 10 12 65.69 1.30 1.4215 2 0 11 12 68.07 3.52 1.3775 3 3 0 6 68.49 1.02 1.3700 4 -1 9 12 69.07 1.61 1.3598 6 -3 2 6 69.24 1.41 1.3569 5 0 4 12 69.99 1.03 1.3442 2 1 11 12 70.08 2.88 1.3428 1 1 12 6 73.21 1.69 1.2929 3 1 10 12 75.88 1.88 1.2538 6 -1 3 12 77.57 1.90 1.2307 6 -1 4 12 77.57 1.98 1.2307 5 1 4 12 78.61 1.40 1.2170 0 0 14 2 79.72 1.80 1.2028 6 -1 5 12 80.52 2.08 1.1929 6 0 0 6 81.39 1.65 1.1823 3 2 10 12 82.34 1.50 1.1711 6 -1 6 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.