Phosphorus Simon A, Borrmann H, Craubner H Phosphorus and Sulfur and the Related Elements 30 (1987) 507-510 Crystal structure of ordered white phosphorus (beta-P) Locality: synthetic Sample: at T = 158.15 K Note: beta phase; transforms from alpha phase at T = 196.75 K _database_code_amcsd 0014997 CELL PARAMETERS: 11.4500 5.5030 11.2610 71.840 90.370 71.560 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 635.231 Density (g/cm3): 1.943 MAX. ABS. INTENSITY / VOLUME**2: 4.444339987 RIR: 0.745 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 16.69 5.54 5.3120 1 1 1 2 17.15 7.59 5.1694 0 1 1 2 17.55 1.10 5.0535 -2 0 1 2 17.73 1.02 5.0035 -1 0 2 2 18.00 3.33 4.9267 0 1 0 2 19.30 72.64 4.5985 2 0 1 2 19.46 50.97 4.5607 1 0 2 2 19.98 62.06 4.4437 2 1 1 2 20.12 2.13 4.4129 0 1 2 2 20.13 41.98 4.4107 1 1 2 2 21.13 100.00 4.2038 -1 1 1 2 21.14 99.00 4.2019 -1 -1 1 2 22.07 69.53 4.0273 -2 0 2 2 22.26 1.22 3.9941 0 -1 1 2 23.16 4.33 3.8412 -2 -1 1 2 23.30 4.53 3.8169 2 1 2 2 24.76 38.76 3.5960 3 0 0 2 25.14 49.77 3.5424 0 0 3 2 25.30 31.14 3.5199 3 1 0 2 25.66 36.84 3.4712 0 1 3 2 25.99 3.82 3.4284 1 1 3 2 27.19 1.18 3.2802 -2 1 1 2 27.65 3.63 3.2258 -3 -1 1 2 27.94 1.36 3.1929 -1 1 3 2 28.30 2.30 3.1536 -3 0 2 2 28.33 2.73 3.1500 -2 1 0 2 28.62 1.16 3.1189 -2 1 2 2 28.64 3.35 3.1173 -2 -1 2 2 28.66 2.78 3.1150 3 1 2 2 31.80 1.04 2.8143 2 0 3 2 31.81 2.74 2.8135 2 -1 1 2 31.91 4.93 2.8045 1 -1 2 2 32.05 4.37 2.7924 4 1 0 2 32.32 1.07 2.7695 -2 1 3 2 32.57 5.17 2.7489 0 1 4 2 32.61 5.09 2.7461 4 1 1 2 32.76 4.93 2.7339 1 2 1 2 33.08 6.41 2.7077 2 2 1 2 33.09 1.37 2.7071 1 1 4 2 33.17 3.05 2.7005 1 2 2 2 33.37 1.38 2.6849 -3 0 3 2 33.63 4.41 2.6650 3 1 3 2 33.73 9.18 2.6574 -4 -1 1 2 33.75 1.31 2.6560 2 2 2 2 33.79 5.95 2.6525 -1 0 4 2 34.19 4.42 2.6224 -1 1 4 2 34.32 18.43 2.6129 -3 1 1 2 34.53 5.69 2.5978 1 2 0 2 34.55 1.12 2.5960 0 2 1 2 35.26 3.97 2.5457 -3 1 2 2 35.30 6.13 2.5427 4 1 2 2 35.48 1.47 2.5304 3 2 1 2 35.50 5.75 2.5290 -3 1 0 2 35.53 4.77 2.5267 -4 0 2 2 35.66 1.97 2.5177 2 1 4 2 35.71 13.47 2.5144 1 2 3 2 35.78 24.80 2.5095 0 -1 3 2 36.33 1.31 2.4726 3 2 2 2 36.47 1.80 2.4634 0 2 0 2 36.67 5.90 2.4508 3 2 0 2 37.66 2.53 2.3883 3 0 3 2 38.12 1.32 2.3608 -1 2 2 2 38.18 2.22 2.3570 -3 -1 3 2 38.20 2.14 2.3560 -1 2 1 2 39.18 11.58 2.2993 4 0 2 2 39.52 3.89 2.2804 2 0 4 2 39.75 1.02 2.2678 4 1 3 2 40.60 3.94 2.2218 4 2 2 2 40.92 3.27 2.2053 2 2 4 2 42.11 3.95 2.1457 -4 1 1 2 42.52 7.90 2.1260 -1 -1 4 2 42.71 2.76 2.1172 -3 1 4 2 42.74 1.33 2.1155 5 1 2 2 43.14 6.22 2.0970 -4 -2 1 2 43.32 1.49 2.0886 3 -1 2 2 43.45 1.04 2.0826 2 -1 3 2 43.50 2.66 2.0803 -1 2 4 2 43.54 2.19 2.0784 3 2 4 2 44.39 1.26 2.0407 1 0 5 2 44.71 1.09 2.0269 3 0 4 2 45.02 7.20 2.0136 -4 0 4 2 45.08 1.72 2.0109 5 2 1 2 46.18 1.11 1.9659 5 2 2 2 46.67 2.31 1.9462 -5 0 3 2 46.68 1.84 1.9459 2 2 5 2 48.47 6.86 1.8782 -1 2 5 2 48.52 1.91 1.8763 -3 1 5 2 48.85 1.95 1.8643 -4 1 4 2 48.86 5.13 1.8641 2 -2 1 2 48.93 1.62 1.8614 1 -2 2 2 49.24 1.23 1.8505 3 2 5 2 50.48 1.15 1.8078 -6 0 1 2 50.53 1.06 1.8063 3 3 2 2 50.64 1.28 1.8027 2 3 3 2 50.78 3.85 1.7980 6 0 0 2 50.79 1.45 1.7977 6 1 2 2 50.99 6.02 1.7911 3 3 1 2 51.16 4.38 1.7855 1 3 3 2 51.24 10.70 1.7830 -2 -1 5 2 51.55 3.01 1.7728 -4 0 5 2 51.60 7.92 1.7712 0 0 6 2 51.63 6.50 1.7704 -5 1 0 2 51.64 7.07 1.7701 -5 -2 2 2 51.96 12.61 1.7600 6 2 0 2 52.08 1.64 1.7560 -2 2 5 2 52.32 9.15 1.7485 4 1 5 2 52.36 11.06 1.7473 1 2 6 2 52.53 1.11 1.7420 2 3 0 2 52.60 6.87 1.7399 -5 1 3 2 52.74 1.29 1.7356 0 2 6 2 52.91 1.16 1.7304 -3 2 4 2 52.98 4.56 1.7282 5 2 4 2 53.56 4.20 1.7111 1 3 0 2 53.57 5.77 1.7106 0 3 1 2 54.33 4.56 1.6886 5 -1 1 2 54.54 9.61 1.6825 6 1 3 2 54.76 4.73 1.6763 -6 -1 3 2 54.86 9.64 1.6735 1 -1 5 2 55.06 1.22 1.6678 -3 0 6 2 55.18 1.66 1.6647 0 3 4 2 55.33 2.39 1.6604 -3 1 6 2 55.38 1.34 1.6590 6 2 3 2 55.89 1.29 1.6451 -5 1 4 2 56.07 2.62 1.6401 -4 2 2 2 56.11 1.48 1.6391 -2 -3 1 2 56.16 1.12 1.6379 -1 3 2 2 56.55 3.08 1.6273 5 3 1 2 56.63 2.24 1.6252 -4 2 1 2 56.89 3.04 1.6186 2 3 5 2 56.97 4.72 1.6163 -1 -2 4 2 57.25 1.27 1.6093 -1 3 1 2 57.26 1.72 1.6090 -1 -3 1 2 57.29 1.13 1.6082 0 1 7 2 58.13 2.40 1.5868 5 0 4 2 59.17 1.12 1.5614 -6 1 1 2 59.63 1.57 1.5506 3 -2 2 2 60.45 1.28 1.5314 -5 1 5 2 60.47 1.47 1.5309 -5 -1 5 2 61.18 1.01 1.5149 0 -1 6 2 61.91 1.07 1.4988 1 3 6 2 61.93 1.04 1.4984 4 -2 1 2 64.01 1.87 1.4547 -5 0 6 2 66.14 1.19 1.4128 -5 1 6 2 68.66 2.35 1.3669 2 4 2 2 68.97 1.30 1.3616 0 3 7 2 69.40 1.61 1.3543 -1 -1 7 2 70.44 1.85 1.3368 -7 -3 1 2 70.70 1.06 1.3325 6 2 6 2 73.57 1.20 1.2874 7 1 5 2 84.22 1.17 1.1497 -5 -3 5 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.