Bismuthinite Kyono A, Kimata M American Mineralogist 89 (2004) 932-940 Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb0.362Bi1.638S3 _database_code_amcsd 0003560 CELL PARAMETERS: 11.3100 3.9526 11.1190 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 497.063 Density (g/cm3): 6.448 MAX. ABS. INTENSITY / VOLUME**2: 79.50777919 RIR: 4.015 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.16 3.13 7.9290 1 0 1 4 15.67 29.55 5.6550 2 0 0 2 15.94 8.31 5.5595 0 0 2 2 17.60 31.10 5.0406 2 0 1 4 17.78 6.75 4.9893 1 0 2 4 22.43 49.82 3.9645 2 0 2 4 23.89 28.76 3.7243 0 1 1 4 24.94 90.85 3.5704 3 0 1 4 25.18 47.79 3.5374 1 1 1 8 25.29 83.07 3.5220 1 0 3 4 27.53 20.91 3.2397 2 1 0 4 28.61 12.21 3.1202 3 0 2 4 28.70 40.12 3.1103 2 1 1 8 28.80 13.30 3.0999 2 0 3 4 28.82 100.00 3.0982 1 1 2 8 31.97 83.16 2.7991 2 1 2 8 33.13 34.13 2.7036 0 1 3 4 33.19 5.67 2.6994 1 0 4 4 33.83 1.34 2.6495 3 1 1 8 33.92 1.41 2.6430 3 0 3 4 34.10 24.01 2.6296 1 1 3 8 35.62 41.75 2.5203 4 0 2 4 36.00 12.19 2.4947 2 0 4 4 36.69 16.15 2.4491 3 1 2 8 39.17 25.00 2.2997 4 1 0 4 40.04 36.89 2.2520 4 1 1 8 40.11 4.69 2.2480 4 0 3 4 40.31 3.64 2.2373 3 0 4 4 40.47 12.35 2.2292 1 1 4 8 41.08 2.33 2.1971 3 1 3 8 41.38 3.22 2.1820 1 0 5 4 42.54 6.26 2.1250 4 1 2 8 42.87 15.72 2.1096 2 1 4 8 43.18 10.55 2.0952 5 0 2 4 43.74 8.92 2.0695 2 0 5 4 45.77 6.74 1.9822 4 0 4 4 45.92 33.23 1.9763 0 2 0 2 46.47 2.42 1.9541 4 1 3 8 46.65 53.96 1.9470 3 1 4 8 46.88 27.86 1.9381 0 1 5 4 47.00 10.21 1.9333 5 1 1 8 47.07 8.58 1.9308 5 0 3 4 47.47 16.51 1.9154 3 0 5 4 47.60 2.74 1.9103 1 1 5 8 48.28 11.75 1.8850 6 0 0 2 48.81 2.93 1.8657 2 2 0 4 49.01 2.07 1.8585 6 0 1 4 49.16 6.66 1.8532 0 0 6 2 49.22 9.99 1.8512 5 1 2 8 49.54 3.56 1.8399 2 2 1 8 49.86 5.97 1.8288 1 0 6 4 51.17 1.32 1.7852 6 0 2 4 51.68 9.67 1.7687 2 2 2 8 51.92 4.20 1.7610 2 0 6 4 52.34 4.62 1.7480 4 0 5 4 52.77 16.15 1.7349 5 1 3 8 52.96 20.88 1.7291 3 2 1 8 53.14 4.20 1.7237 3 1 5 8 53.14 19.95 1.7235 1 2 3 8 53.89 13.64 1.7014 6 1 0 4 54.56 2.90 1.6818 6 1 1 8 54.62 2.33 1.6802 6 0 3 4 55.00 3.01 1.6696 3 2 2 8 55.11 3.65 1.6664 2 2 3 8 55.35 3.19 1.6597 1 1 6 8 57.47 1.30 1.6036 5 1 4 8 57.82 2.20 1.5946 1 2 4 8 59.43 16.01 1.5552 4 2 2 8 59.65 3.11 1.5499 4 0 6 4 59.69 4.72 1.5491 2 2 4 8 59.81 3.32 1.5463 6 1 3 8 60.38 2.96 1.5329 3 1 6 8 60.55 7.53 1.5292 2 0 7 4 62.58 2.15 1.4843 4 2 3 8 62.68 6.51 1.4822 7 1 1 8 62.73 1.71 1.4812 3 2 4 8 62.73 8.12 1.4811 7 0 3 4 63.51 1.57 1.4648 1 2 5 8 64.52 4.70 1.4442 7 1 2 8 64.59 2.30 1.4430 4 1 6 8 64.84 2.36 1.4379 6 0 5 4 64.86 5.40 1.4377 5 2 2 8 65.07 1.96 1.4335 5 0 6 4 65.28 4.52 1.4293 2 2 5 8 65.44 11.19 1.4262 2 1 7 8 66.69 1.54 1.4025 8 0 1 4 66.85 3.71 1.3996 4 2 4 8 66.99 4.79 1.3969 7 0 4 4 67.38 1.75 1.3899 0 0 8 2 67.86 4.95 1.3811 5 2 3 8 67.95 1.26 1.3795 1 0 8 4 68.18 9.53 1.3754 3 2 5 8 68.83 6.97 1.3640 6 2 0 4 69.42 1.27 1.3539 6 2 1 8 69.54 4.06 1.3518 0 2 6 4 69.57 10.09 1.3513 6 1 5 8 70.11 3.66 1.3423 1 2 6 8 71.36 1.38 1.3217 8 1 1 8 71.38 2.26 1.3215 6 0 6 4 71.80 2.76 1.3148 2 2 6 8 72.14 3.03 1.3093 4 2 5 8 72.20 1.02 1.3084 0 3 1 4 72.29 14.03 1.3070 4 1 7 8 72.58 6.10 1.3025 1 1 8 8 72.76 1.94 1.2997 1 3 1 8 73.10 6.74 1.2946 8 1 2 8 74.06 1.61 1.2801 6 2 3 8 74.43 2.16 1.2747 2 3 1 8 74.48 4.96 1.2739 1 3 2 8 75.92 2.05 1.2533 6 1 6 8 76.13 4.89 1.2503 2 3 2 8 76.25 2.86 1.2487 9 0 1 4 76.78 2.12 1.2414 0 3 3 4 76.81 2.62 1.2410 7 1 5 8 77.32 1.60 1.2340 1 3 3 8 77.76 1.53 1.2281 1 0 9 4 78.41 2.45 1.2196 4 2 6 8 78.86 1.28 1.2138 3 3 2 8 79.20 5.96 1.2094 2 2 7 8 79.90 3.45 1.2006 8 1 4 8 80.41 2.27 1.1942 4 3 0 4 80.70 1.88 1.1907 9 1 1 8 80.97 3.53 1.1874 4 3 1 8 81.15 6.77 1.1852 7 2 3 8 81.24 2.66 1.1842 5 0 8 4 81.25 1.23 1.1840 1 3 4 8 81.65 3.90 1.1792 0 1 9 4 82.09 2.05 1.1740 3 0 9 4 82.86 1.70 1.1650 2 3 4 8 82.96 3.48 1.1638 7 1 6 8 83.06 2.05 1.1627 6 2 5 8 83.27 1.67 1.1604 5 2 6 8 84.64 1.90 1.1451 9 0 4 4 84.76 1.37 1.1437 8 2 1 8 84.90 1.07 1.1422 8 1 5 8 85.04 4.37 1.1407 7 2 4 8 85.39 1.62 1.1369 0 2 8 4 85.54 7.05 1.1353 3 3 4 8 85.62 1.74 1.1344 5 1 8 8 85.70 3.65 1.1335 0 3 5 4 85.79 1.32 1.1326 5 3 1 8 85.92 1.15 1.1312 1 2 8 8 86.49 1.07 1.1252 10 0 1 4 87.45 1.46 1.1153 5 3 2 8 88.15 1.44 1.1083 10 0 2 4 89.00 2.75 1.0999 9 1 4 8 89.14 2.25 1.0985 6 2 6 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.