# TITLE *-Cr-[IM3-M] Straumanis, M.E.;Weng, C.C.[1963] [alpha phase] # CELL 2.884940 2.884940 2.884940 90.000000 90.000000 90.000000 # SPCGRP I M 3 M CUBIC STRUCTURE # ATOM CR 1 0.000000 0.000000 0.000000 # SCATTERING FACTOR COEFFICIENTS: CR F= 0.364 CM-12 # Reference: Zeitschrift fuer Kristallographie (1983) 162, 151-153 # # Physical parameters: # sigma_coh 1.660 coherent scattering cross section (single atom) in [barn] # sigma_inc 1.83 incoherent scattering cross section (single atom) in [barn] # sigma_abs 3.05 absorption scattering cross section (single atom) in [barn] # density 7.15 in [g/cm^3] # weight 51.99 in [g/mol] (single atom) # multiplicity 2 in [atoms/unit cell] # Vc 24.01 volume of unit cell in [A^3] # v_sound 5940 in [m/s] # T_m 2180 melting temperature in [K] # T_b 2944 boiling temperature in [K] # At_number 24 atomic number Z # lattice_a 2.88494 lattice parameter a in [Angs] # # Format parameters: Lazy format # column_j 17 multiplicity 'j' # column_d 6 d-spacing 'd' in [Angs] # column_F 13 norm of scattering factor |F| in [barn^0.5] # column_h 1 # column_k 2 # column_l 3 # # H K L THETA 2THETA D VALUE 1/D**2 SIN2*1000 H K L INTENSITY /F(HKL)/ A(HKL) B(HKL) PHA.ANG. MULT LPG 1 1 0 14.19 28.38 2.0400 0.2403 60.08 1 1 0 1000.0 0.7 0.69 0.00 0.00 12 17.17 2 0 0 20.28 40.56 1.4425 0.4806 120.15 2 0 0 229.1 0.6 0.65 0.00 0.00 6 8.87 2 1 1 25.12 50.24 1.1778 0.7209 180.23 2 1 1 561.4 0.6 0.61 0.00 0.00 24 6.13 2 2 0 29.35 58.71 1.0200 0.9612 240.30 2 2 0 193.9 0.6 0.57 0.00 0.00 12 4.77 3 1 0 33.23 66.47 0.9123 1.2015 300.38 3 1 0 286.7 0.5 0.54 0.00 0.00 24 3.98 2 2 2 36.90 73.79 0.8328 1.4418 360.45 2 2 2 73.9 0.5 0.51 0.00 0.00 8 3.47 3 2 1 40.43 80.85 0.7710 1.6821 420.53 3 2 1 353.9 0.5 0.48 0.00 0.00 48 3.12 4 0 0 43.89 87.78 0.7212 1.9224 480.60 4 0 0 36.3 0.5 0.45 0.00 0.00 6 2.89 3 3 0 47.33 94.67 0.6800 2.1627 540.68 3 3 0 60.8 0.4 0.42 0.00 0.00 12 2.73 4 1 1 47.33 94.67 0.6800 2.1627 540.68 4 1 1 121.6 0.4 0.42 0.00 0.00 24 2.73 4 2 0 50.81 101.63 0.6451 2.4030 600.75 4 2 0 104.1 0.4 0.40 0.00 0.00 24 2.63 3 3 2 54.38 108.76 0.6151 2.6433 660.83 3 3 2 91.0 0.4 0.38 0.00 0.00 24 2.60 4 2 2 58.11 116.22 0.5889 2.8836 720.90 4 2 2 81.6 0.4 0.35 0.00 0.00 24 2.63 4 3 1 62.10 124.19 0.5658 3.1239 780.98 4 3 1 150.7 0.3 0.33 0.00 0.00 48 2.74 5 1 0 62.10 124.19 0.5658 3.1239 780.98 5 1 0 75.4 0.3 0.33 0.00 0.00 24 2.74 5 2 1 71.67 143.35 0.5267 3.6045 901.13 5 2 1 152.9 0.3 0.30 0.00 0.00 48 3.53 4 4 0 78.64 157.28 0.5100 3.8448 961.21 4 4 0 50.7 0.3 0.28 0.00 0.00 12 5.28