# BeO crystal, used for Berylium filters # a=b=2.714, c=4.405; aa=bb=90, cc=120; # # Physical parameters: # sigma_coh 11.85 coherent scattering cross section in [barn] # sigma_inc 0.003 incoherent scattering cross section in [barn] # sigma_abs 0.008 absorption scattering cross section in [barn] # density 3.01 in [g/cm^3] # weight 25.01 in [g/mol] # nb_atoms 4 in [atoms/unit cell] # T_m 2650 melting temperature in [K] # T_b 3243 boiling temperature in [K] # lattice_a 2.9508 lattice parameter a in [Angs] # lattice_c 4.6855 lattice parameter c in [Angs] # lattice_cc 120 lattice angle gamma in [deg] # # Format parameters: Crystallographica format # column_j 4 multiplicity 'j' # column_d 5 d-spacing 'd' in [Angs] # column_F2 7 norm of scattering factor |F|^2 in [fm^2] # column_h 1 # column_k 2 # column_l 3 # # h k l Mult. d-space 2Theta F-squared 0 0 1 1 4.4078 26.2258 0 0 0 -1 1 4.4078 26.2258 0 1 -1 0 6 2.35368 50.2844 1.27432 -1 1 0 6 2.35368 50.2844 1.27432 1 0 0 6 2.35368 50.2844 1.27432 0 1 0 6 2.35368 50.2844 1.27432 0 -1 0 6 2.35368 50.2844 1.27432 -1 0 0 6 2.35368 50.2844 1.27432 0 0 2 1 2.2039 53.968 2.58117 0 0 -2 1 2.2039 53.968 2.58117 1 -1 -1 6 2.07622 57.5857 0.543945 -1 1 1 6 2.07622 57.5857 0.543945 0 1 1 6 2.07622 57.5857 0.543945 0 -1 -1 6 2.07622 57.5857 0.543945 1 0 1 6 2.07622 57.5857 0.543945 1 -1 1 6 2.07622 57.5857 0.543945 0 1 -1 6 2.07622 57.5857 0.543945 0 -1 1 6 2.07622 57.5857 0.543945 -1 1 -1 6 2.07622 57.5857 0.543945 -1 0 -1 6 2.07622 57.5857 0.543945 1 0 -1 6 2.07622 57.5857 0.543944 -1 0 1 6 2.07622 57.5857 0.543944 1 0 -2 6 1.60874 76.8668 0.451867 1 -1 2 6 1.60874 76.8668 0.451867 -1 1 -2 6 1.60874 76.8668 0.451867 -1 0 2 6 1.60874 76.8668 0.451867 0 1 2 6 1.60874 76.8668 0.451867 0 -1 -2 6 1.60874 76.8668 0.451867 1 -1 -2 6 1.60874 76.8668 0.451867 -1 1 2 6 1.60874 76.8668 0.451867 0 1 -2 6 1.60874 76.8668 0.451867 0 -1 2 6 1.60874 76.8668 0.451867 1 0 2 6 1.60874 76.8668 0.451867 -1 0 -2 6 1.60874 76.8668 0.451867 0 0 3 1 1.46927 85.783 0 0 0 -3 1 1.46927 85.783 0 2 -1 0 6 1.3589 94.7649 2.49946 1 1 0 6 1.3589 94.7649 2.49946 1 -2 0 6 1.3589 94.7649 2.49946 -1 2 0 6 1.3589 94.7649 2.49946 -1 -1 0 6 1.3589 94.7649 2.49946 -2 1 0 6 1.3589 94.7649 2.49946 2 -1 1 6 1.29859 100.72 0 2 -1 -1 6 1.29859 100.72 0 1 1 1 6 1.29859 100.72 0 1 1 -1 6 1.29859 100.72 0 1 -2 1 6 1.29859 100.72 0 1 -2 -1 6 1.29859 100.72 0 -1 2 1 6 1.29859 100.72 0 -1 2 -1 6 1.29859 100.72 0 -1 -1 1 6 1.29859 100.72 0 -1 -1 -1 6 1.29859 100.72 0 -2 1 1 6 1.29859 100.72 0 -2 1 -1 6 1.29859 100.72 0 1 -1 -3 6 1.24636 106.708 1.27653 0 1 -3 6 1.24636 106.708 1.27653 0 -1 3 6 1.24636 106.708 1.27653 -1 1 3 6 1.24636 106.708 1.27653 1 0 3 6 1.24636 106.708 1.27653 1 0 -3 6 1.24636 106.708 1.27653 1 -1 3 6 1.24636 106.708 1.27653 0 1 3 6 1.24636 106.708 1.27653 0 -1 -3 6 1.24636 106.708 1.27653 -1 1 -3 6 1.24636 106.708 1.27653 -1 0 3 6 1.24636 106.708 1.27653 -1 0 -3 6 1.24636 106.708 1.27653 0 2 0 6 1.17684 116.365 0.437564 0 -2 0 6 1.17684 116.365 0.437564 2 0 0 6 1.17684 116.365 0.437564 2 -2 0 6 1.17684 116.365 0.437564 -2 2 0 6 1.17684 116.365 0.437564 -2 0 0 6 1.17684 116.365 0.437564 1 1 -2 6 1.1567 119.659 0.886298 1 -2 2 6 1.1567 119.659 0.886298 -1 2 -2 6 1.1567 119.659 0.886298 -1 -1 2 6 1.1567 119.659 0.886298 2 -1 2 6 1.1567 119.659 0.886298 2 -1 -2 6 1.1567 119.659 0.886298 1 1 2 6 1.1567 119.659 0.886298 1 -2 -2 6 1.1567 119.659 0.886298 -1 2 2 6 1.1567 119.659 0.886298 -1 -1 -2 6 1.1567 119.659 0.886298 -2 1 2 6 1.1567 119.659 0.886298 -2 1 -2 6 1.1567 119.659 0.886298 0 2 -1 6 1.13701 123.164 0.186775 0 -2 1 6 1.13701 123.164 0.186775 0 2 1 6 1.13701 123.164 0.186775 0 -2 -1 6 1.13701 123.164 0.186775 2 0 -1 6 1.13701 123.164 0.186775 2 -2 1 6 1.13701 123.164 0.186775 -2 2 -1 6 1.13701 123.164 0.186775 -2 0 1 6 1.13701 123.164 0.186775 2 0 1 6 1.13701 123.164 0.186774 -2 0 -1 6 1.13701 123.164 0.186774 2 -2 -1 6 1.13701 123.164 0.186774 -2 2 1 6 1.13701 123.164 0.186774 0 0 4 1 1.10195 130.32 0.0338829 0 0 -4 1 1.10195 130.32 0.0338829 2 0 2 6 1.03811 148.854 0.155158 0 2 -2 6 1.03811 148.854 0.155158 0 -2 2 6 1.03811 148.854 0.155158 -2 0 -2 6 1.03811 148.854 0.155158 2 -2 -2 6 1.03811 148.854 0.155158 -2 2 2 6 1.03811 148.854 0.155158 0 2 2 6 1.03811 148.854 0.155158 0 -2 -2 6 1.03811 148.854 0.155158 2 0 -2 6 1.03811 148.854 0.155158 2 -2 2 6 1.03811 148.854 0.155158 -2 2 -2 6 1.03811 148.854 0.155158 -2 0 2 6 1.03811 148.854 0.155158