# TITLE *-Ge-[FD3-MS] Cooper, A.S.[1983] [irritant] # CELL 5.656750 5.656750 5.656750 90.000000 90.000000 90.000000 # SPCGRP F D 3 M CUBIC STRUCTURE # ATOM GE 1 0.000000 0.000000 0.000000 # SCATTERING FACTOR COEFFICIENTS: GE F= 0.819 CM-12 # Reference: Physical Review, Serie 3. B - Condensed Matter (1994) 50, 14947-14951 # # Physical parameters: # sigma_coh 8.42 coherent scattering cross section in [barn] # sigma_inc 0 incoherent scattering cross section in [barn] (was 0.18) # sigma_abs 0 absorption scattering cross section in [barn] (was 2.2) # density 5.323 in [g/cm^3] # weight 72.64 in [g/mol] # nb_atoms 16 in [atoms/unit cell] # v_sound 5400 in [m/s] # T_m 1211.4 melting temperature in [K] # T_b 3093 boiling temperature in [K] # At_number 32 atomic number Z # lattice_a 5.65735 lattice parameter a in [Angs] (was 5.65675) # # 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 1 1 1 8 3.26627 27.1355 1781.69 -1 -1 -1 8 3.26627 27.1355 1781.69 1 1 -1 8 3.26627 27.1355 1781.69 1 -1 1 8 3.26627 27.1355 1781.69 1 -1 -1 8 3.26627 27.1355 1781.69 -1 1 1 8 3.26627 27.1355 1781.69 -1 1 -1 8 3.26627 27.1355 1781.69 -1 -1 1 8 3.26627 27.1355 1781.69 2 2 0 12 2.00018 45.0506 2617.82 2 0 2 12 2.00018 45.0506 2617.82 2 0 -2 12 2.00018 45.0506 2617.82 2 -2 0 12 2.00018 45.0506 2617.82 0 2 2 12 2.00018 45.0506 2617.82 0 2 -2 12 2.00018 45.0506 2617.82 0 -2 2 12 2.00018 45.0506 2617.82 0 -2 -2 12 2.00018 45.0506 2617.82 -2 2 0 12 2.00018 45.0506 2617.82 -2 0 2 12 2.00018 45.0506 2617.82 -2 0 -2 12 2.00018 45.0506 2617.82 -2 -2 0 12 2.00018 45.0506 2617.82 1 3 -1 24 1.70576 53.3866 1087.82 1 -1 3 24 1.70576 53.3866 1087.82 1 -1 -3 24 1.70576 53.3866 1087.82 1 -3 -1 24 1.70576 53.3866 1087.82 -1 3 1 24 1.70576 53.3866 1087.82 -1 1 3 24 1.70576 53.3866 1087.82 -1 1 -3 24 1.70576 53.3866 1087.82 -1 -3 1 24 1.70576 53.3866 1087.82 3 1 -1 24 1.70576 53.3866 1087.81 3 -1 1 24 1.70576 53.3866 1087.81 -3 1 -1 24 1.70576 53.3866 1087.81 -3 -1 1 24 1.70576 53.3866 1087.81 3 -1 -1 24 1.70576 53.3866 1087.81 1 1 -3 24 1.70576 53.3866 1087.81 1 -3 1 24 1.70576 53.3866 1087.81 -1 3 -1 24 1.70576 53.3866 1087.81 -1 -1 3 24 1.70576 53.3866 1087.81 -3 1 1 24 1.70576 53.3866 1087.81 3 1 1 24 1.70576 53.3866 1087.81 1 3 1 24 1.70576 53.3866 1087.81 1 1 3 24 1.70576 53.3866 1087.81 -1 -1 -3 24 1.70576 53.3866 1087.81 -1 -3 -1 24 1.70576 53.3866 1087.81 -3 -1 -1 24 1.70576 53.3866 1087.81 3 3 1 24 1.29789 72.3685 664.166 3 1 3 24 1.29789 72.3685 664.166 -3 -1 -3 24 1.29789 72.3685 664.166 -3 -3 -1 24 1.29789 72.3685 664.166 1 3 3 24 1.29789 72.3685 664.166 -1 -3 -3 24 1.29789 72.3685 664.166 3 3 -1 24 1.29789 72.3685 664.166 3 1 -3 24 1.29789 72.3685 664.166 3 -3 1 24 1.29789 72.3685 664.166 1 -3 3 24 1.29789 72.3685 664.166 -1 3 -3 24 1.29789 72.3685 664.166 -3 3 -1 24 1.29789 72.3685 664.166 -3 -1 3 24 1.29789 72.3685 664.166 -3 -3 1 24 1.29789 72.3685 664.166 3 -1 3 24 1.29789 72.3685 664.166 3 -1 -3 24 1.29789 72.3685 664.166 3 -3 -1 24 1.29789 72.3685 664.166 1 3 -3 24 1.29789 72.3685 664.166 1 -3 -3 24 1.29789 72.3685 664.166 -1 3 3 24 1.29789 72.3685 664.166 -1 -3 3 24 1.29789 72.3685 664.166 -3 3 1 24 1.29789 72.3685 664.166 -3 1 3 24 1.29789 72.3685 664.166 -3 1 -3 24 1.29789 72.3685 664.166 3 -3 -3 8 1.08876 89.4628 405.507 -3 3 3 8 1.08876 89.4628 405.507 3 3 -3 8 1.08876 89.4628 405.507 -3 -3 3 8 1.08876 89.4628 405.507 3 3 3 8 1.08876 89.4628 405.507 -3 -3 -3 8 1.08876 89.4628 405.507 3 -3 3 8 1.08876 89.4628 405.507 -3 3 -3 8 1.08876 89.4628 405.507