Bismuthinite Lundegaard L F, Makovicky E, Boffa Ballaran T, Balic-Zunic T Physics and Chemistry of Minerals 32 (2005) 578-584 Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa Locality: synthetic Sample: P = 8.30 GPa _database_code_amcsd 0009010 CELL PARAMETERS: 10.6590 3.8525 10.5100 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 431.581 Density (g/cm3): 7.912 MAX. ABS. INTENSITY / VOLUME**2: 103.3338857 RIR: 4.253 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 16.63 14.75 5.3295 2 0 0 2 16.87 8.20 5.2550 0 0 2 2 18.67 3.65 4.7533 2 0 1 4 18.83 15.10 4.7133 1 0 2 4 23.78 77.79 3.7419 2 0 2 4 24.61 32.35 3.6172 0 1 1 4 26.01 55.37 3.4253 1 1 1 8 26.48 100.00 3.3659 3 0 1 4 26.79 81.83 3.3282 1 0 3 4 28.59 39.21 3.1222 2 1 0 4 29.85 52.13 2.9929 2 1 1 8 29.96 99.32 2.9829 1 1 2 8 30.37 3.45 2.9434 3 0 2 4 30.54 11.89 2.9275 2 0 3 4 33.38 51.97 2.6842 2 1 2 8 33.63 6.97 2.6648 4 0 0 2 34.12 1.13 2.6275 0 0 4 2 34.61 34.87 2.5919 0 1 3 4 34.73 7.62 2.5830 4 0 1 4 35.18 3.90 2.5511 1 0 4 4 35.41 6.03 2.5347 3 1 1 8 35.65 41.70 2.5185 1 1 3 8 36.00 1.27 2.4946 3 0 3 4 37.86 28.58 2.3766 4 0 2 4 38.19 17.99 2.3567 2 0 4 4 38.49 17.07 2.3389 3 1 2 8 38.63 1.69 2.3309 2 1 3 8 41.19 13.92 2.1916 4 1 0 4 42.12 41.06 2.1454 4 1 1 8 42.50 16.95 2.1270 1 1 4 8 42.63 5.07 2.1209 4 0 3 4 43.31 1.72 2.0893 5 0 1 4 43.90 3.47 2.0623 1 0 5 4 44.81 27.99 2.0227 4 1 2 8 45.10 10.52 2.0103 2 1 4 8 46.44 11.64 1.9554 2 0 5 4 47.18 35.92 1.9262 0 2 0 2 48.67 3.19 1.8710 4 0 4 4 49.19 56.43 1.8524 3 1 4 8 49.39 25.50 1.8452 0 1 5 4 49.64 13.57 1.8366 5 1 1 8 50.09 22.26 1.8211 5 0 3 4 50.18 2.55 1.8182 1 1 5 8 50.37 1.61 1.8116 2 2 0 4 50.44 18.04 1.8091 3 0 5 4 51.23 2.04 1.7831 1 2 2 8 51.44 14.82 1.7765 6 0 0 2 52.02 20.00 1.7578 5 1 2 8 52.22 6.72 1.7517 0 0 6 2 52.98 7.50 1.7285 1 0 6 4 53.50 15.97 1.7126 2 2 2 8 54.52 3.68 1.6830 4 1 4 8 54.53 1.02 1.6829 6 0 2 4 54.92 24.40 1.6718 3 2 1 8 55.09 20.70 1.6672 1 2 3 8 55.20 4.16 1.6641 2 0 6 4 55.51 2.86 1.6555 5 0 4 4 55.70 2.58 1.6504 4 0 5 4 57.25 3.46 1.6092 2 2 3 8 57.82 5.35 1.5946 6 1 1 8 58.53 2.83 1.5770 1 1 6 8 59.19 2.45 1.5611 4 2 0 4 59.90 2.58 1.5442 4 2 1 8 60.20 1.63 1.5373 1 2 4 8 62.02 11.52 1.4965 4 2 2 8 62.25 7.34 1.4914 2 2 4 8 63.48 3.35 1.4653 6 1 3 8 63.56 4.13 1.4637 4 0 6 4 63.62 1.06 1.4626 7 0 2 4 64.00 2.78 1.4548 3 1 6 8 64.48 3.30 1.4452 2 0 7 4 65.45 2.47 1.4259 4 2 3 8 66.41 1.79 1.4077 1 2 5 8 66.64 6.09 1.4034 7 1 1 8 67.01 6.15 1.3965 7 0 3 4 67.09 2.02 1.3952 5 1 5 8 68.36 6.28 1.3723 2 2 5 8 68.64 4.18 1.3673 7 1 2 8 69.46 15.80 1.3531 2 1 7 8 70.12 1.87 1.3421 4 2 4 8 71.26 13.59 1.3233 5 2 3 8 71.55 11.02 1.3187 3 2 5 8 71.63 1.37 1.3175 7 0 4 4 71.86 1.37 1.3138 0 0 8 2 71.91 6.76 1.3129 7 1 3 8 72.22 2.90 1.3081 4 0 7 4 72.36 9.36 1.3059 6 2 0 4 72.49 1.71 1.3039 1 0 8 4 73.01 4.33 1.2960 0 2 6 4 73.30 3.82 1.2915 8 0 2 4 73.63 4.86 1.2865 1 2 6 8 74.08 13.28 1.2798 6 1 5 8 74.28 4.35 1.2769 5 1 6 8 74.43 1.16 1.2747 0 3 1 4 75.05 2.34 1.2657 1 3 1 8 75.50 2.90 1.2593 2 2 6 8 75.50 2.19 1.2592 8 1 0 4 75.76 1.98 1.2555 5 2 4 8 75.92 1.79 1.2533 4 2 5 8 76.14 5.79 1.2503 8 1 1 8 76.27 1.84 1.2484 2 3 0 4 76.35 3.69 1.2473 6 0 6 4 76.40 4.69 1.2466 7 1 4 8 76.90 2.95 1.2397 2 3 1 8 76.96 5.18 1.2390 1 3 2 8 76.98 9.79 1.2386 4 1 7 8 77.25 5.69 1.2351 1 1 8 8 78.79 3.22 1.2146 2 3 2 8 79.49 2.28 1.2057 0 3 3 4 80.10 3.00 1.1981 1 3 3 8 81.84 1.45 1.1770 3 3 2 8 81.85 4.31 1.1769 9 0 1 4 82.83 3.48 1.1654 4 2 6 8 83.23 1.69 1.1608 1 0 9 4 83.58 1.37 1.1568 4 3 0 4 83.65 2.81 1.1560 2 2 7 8 84.20 4.25 1.1499 4 3 1 8 84.26 2.16 1.1492 7 0 6 4 84.46 1.81 1.1470 1 3 4 8 85.98 5.58 1.1306 7 2 3 8 86.06 3.27 1.1298 4 3 2 8 86.26 1.25 1.1276 2 3 4 8 86.46 1.19 1.1255 9 1 1 8 87.23 4.14 1.1176 0 1 9 4 88.04 1.81 1.1094 3 0 9 4 88.86 1.30 1.1013 7 1 6 8 89.26 8.18 1.0973 3 3 4 8 89.42 3.71 1.0958 0 3 5 4 89.60 1.99 1.0940 5 3 1 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.