Phosphorus Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G Journal of Chemical Physics 71 (1979) 1718-1721 Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.66 GPa Note: pressures calculated from the measured unit cell volume _database_code_amcsd 0013018 CELL PARAMETERS: 3.3120 10.1400 4.2290 90.000 90.000 90.000 SPACE GROUP: Cmca X-RAY WAVELENGTH: 1.541838 Cell Volume: 142.025 Density (g/cm3): 2.897 MAX. ABS. INTENSITY / VOLUME**2: 24.32689300 RIR: 2.735 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.49 22.51 5.0700 0 2 0 2 27.46 42.62 3.2475 0 2 1 4 35.41 39.62 2.5350 0 4 0 2 35.55 100.00 2.5254 1 1 1 8 41.53 2.87 2.1743 0 4 1 4 42.76 9.75 2.1145 0 0 2 2 43.85 13.34 2.0646 1 3 1 8 52.10 14.60 1.7553 1 1 2 8 54.28 5.92 1.6900 0 6 0 2 55.49 12.06 1.6560 2 0 0 2 56.69 6.04 1.6238 0 4 2 4 57.58 33.04 1.6008 1 5 1 8 58.55 22.17 1.5765 1 3 2 8 58.65 1.21 1.5742 2 2 0 4 58.84 2.22 1.5693 0 6 1 4 63.01 6.18 1.4753 2 2 1 8 67.57 9.92 1.3864 2 4 0 4 69.17 10.92 1.3581 0 2 3 4 71.46 1.71 1.3202 0 6 2 4 72.50 3.58 1.3038 2 0 2 4 74.92 1.41 1.2675 0 8 0 2 77.47 1.88 1.2320 0 4 3 4 78.83 1.17 1.2141 0 8 1 4 81.35 3.42 1.1828 2 6 0 4 83.35 3.77 1.1594 2 4 2 8 85.19 1.49 1.1391 2 6 1 8 86.60 8.33 1.1241 1 7 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.