# Si crystal, used for Analyzers # a=b=c=5.430530; aa=bb=cc=90 # # Physical parameters: # sigma_coh 2.163 coherent scattering cross section in [barn] # sigma_inc 0.004 incoherent scattering cross section in [barn] # sigma_abs 0.171 absorption scattering cross section in [barn] # density 2.33 in [g/cm^3] # weight 28.08 in [g/mol] # nb_atoms 16 in [atoms/unit cell] # v_sound 2200 in [m/s] # T_m 1687 melting temperature in [K] # T_b 3173 boiling temperature in [K] # At_number 14 atomic number Z # lattice_a 5.43053 lattice parameter a in [Angs] # # 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 [barn] # column_h 1 # column_k 2 # column_l 3 # # h k l Mult. d-space 2Theta F-squared 1 1 0 12 3.83997 14.9634 0 1 0 1 12 3.83997 14.9634 0 1 0 -1 12 3.83997 14.9634 0 1 -1 0 12 3.83997 14.9634 0 0 1 1 12 3.83997 14.9634 0 0 1 -1 12 3.83997 14.9634 0 0 -1 1 12 3.83997 14.9634 0 0 -1 -1 12 3.83997 14.9634 0 -1 1 0 12 3.83997 14.9634 0 -1 0 1 12 3.83997 14.9634 0 -1 0 -1 12 3.83997 14.9634 0 -1 -1 0 12 3.83997 14.9634 0 1 1 1 8 3.13532 18.3527 901.324 1 1 -1 8 3.13532 18.3527 901.324 1 -1 1 8 3.13532 18.3527 901.324 1 -1 -1 8 3.13532 18.3527 901.324 -1 1 1 8 3.13532 18.3527 901.324 -1 1 -1 8 3.13532 18.3527 901.324 -1 -1 1 8 3.13532 18.3527 901.324 -1 -1 -1 8 3.13532 18.3527 901.324 2 0 0 6 2.71527 21.2225 0 0 2 0 6 2.71527 21.2225 0 0 0 2 6 2.71527 21.2225 0 0 0 -2 6 2.71527 21.2225 0 0 -2 0 6 2.71527 21.2225 0 -2 0 0 6 2.71527 21.2225 0 2 1 0 24 2.42861 23.762 0 2 0 1 24 2.42861 23.762 0 2 0 -1 24 2.42861 23.762 0 2 -1 0 24 2.42861 23.762 0 1 2 0 24 2.42861 23.762 0 1 0 2 24 2.42861 23.762 0 1 0 -2 24 2.42861 23.762 0 1 -2 0 24 2.42861 23.762 0 0 2 1 24 2.42861 23.762 0 0 2 -1 24 2.42861 23.762 0 0 1 2 24 2.42861 23.762 0 0 1 -2 24 2.42861 23.762 0 0 -1 2 24 2.42861 23.762 0 0 -1 -2 24 2.42861 23.762 0 0 -2 1 24 2.42861 23.762 0 0 -2 -1 24 2.42861 23.762 0 -1 2 0 24 2.42861 23.762 0 -1 0 2 24 2.42861 23.762 0 -1 0 -2 24 2.42861 23.762 0 -1 -2 0 24 2.42861 23.762 0 -2 1 0 24 2.42861 23.762 0 -2 0 1 24 2.42861 23.762 0 -2 0 -1 24 2.42861 23.762 0 -2 -1 0 24 2.42861 23.762 0 2 1 1 24 2.217 26.068 0 2 1 -1 24 2.217 26.068 0 2 -1 1 24 2.217 26.068 0 2 -1 -1 24 2.217 26.068 0 1 2 1 24 2.217 26.068 0 1 2 -1 24 2.217 26.068 0 1 1 2 24 2.217 26.068 0 1 1 -2 24 2.217 26.068 0 1 -1 2 24 2.217 26.068 0 1 -1 -2 24 2.217 26.068 0 1 -2 1 24 2.217 26.068 0 1 -2 -1 24 2.217 26.068 0 -1 2 1 24 2.217 26.068 0 -1 2 -1 24 2.217 26.068 0 -1 1 2 24 2.217 26.068 0 -1 1 -2 24 2.217 26.068 0 -1 -1 2 24 2.217 26.068 0 -1 -1 -2 24 2.217 26.068 0 -1 -2 1 24 2.217 26.068 0 -1 -2 -1 24 2.217 26.068 0 -2 1 1 24 2.217 26.068 0 -2 1 -1 24 2.217 26.068 0 -2 -1 1 24 2.217 26.068 0 -2 -1 -1 24 2.217 26.068 0 2 0 2 12 1.91998 30.1899 1.36925e-013 -2 0 -2 12 1.91998 30.1899 1.36925e-013 2 0 -2 12 1.91998 30.1899 1.36925e-013 2 -2 0 12 1.91998 30.1899 1.36925e-013 -2 2 0 12 1.91998 30.1899 1.36925e-013 -2 0 2 12 1.91998 30.1899 1.36925e-013 2 2 0 12 1.91998 30.1899 1.36925e-013 -2 -2 0 12 1.91998 30.1899 1.36925e-013 0 2 2 12 1.91998 30.1899 3.25624e-026 0 -2 -2 12 1.91998 30.1899 3.25624e-026 0 2 -2 12 1.91998 30.1899 8.1406e-027 0 -2 2 12 1.91998 30.1899 8.1406e-027 3 0 0 6 1.81018 32.069 0 2 2 1 24 1.81018 32.069 0 2 2 -1 24 1.81018 32.069 0 2 1 2 24 1.81018 32.069 0 2 1 -2 24 1.81018 32.069 0 2 -1 2 24 1.81018 32.069 0 2 -1 -2 24 1.81018 32.069 0 2 -2 1 24 1.81018 32.069 0 2 -2 -1 24 1.81018 32.069 0 1 2 2 24 1.81018 32.069 0 1 2 -2 24 1.81018 32.069 0 1 -2 2 24 1.81018 32.069 0 1 -2 -2 24 1.81018 32.069 0 0 3 0 6 1.81018 32.069 0 0 0 3 6 1.81018 32.069 0 0 0 -3 6 1.81018 32.069 0 0 -3 0 6 1.81018 32.069 0 -1 2 2 24 1.81018 32.069 0 -1 2 -2 24 1.81018 32.069 0 -1 -2 2 24 1.81018 32.069 0 -1 -2 -2 24 1.81018 32.069 0 -2 2 1 24 1.81018 32.069 0 -2 2 -1 24 1.81018 32.069 0 -2 1 2 24 1.81018 32.069 0 -2 1 -2 24 1.81018 32.069 0 -2 -1 2 24 1.81018 32.069 0 -2 -1 -2 24 1.81018 32.069 0 -2 -2 1 24 1.81018 32.069 0 -2 -2 -1 24 1.81018 32.069 0 -3 0 0 6 1.81018 32.069 0 3 1 0 24 1.71728 33.8545 0 3 0 1 24 1.71728 33.8545 0 3 0 -1 24 1.71728 33.8545 0 3 -1 0 24 1.71728 33.8545 0 1 3 0 24 1.71728 33.8545 0 1 0 3 24 1.71728 33.8545 0 1 0 -3 24 1.71728 33.8545 0 1 -3 0 24 1.71728 33.8545 0 0 3 1 24 1.71728 33.8545 0 0 3 -1 24 1.71728 33.8545 0 0 1 3 24 1.71728 33.8545 0 0 1 -3 24 1.71728 33.8545 0 0 -1 3 24 1.71728 33.8545 0 0 -1 -3 24 1.71728 33.8545 0 0 -3 1 24 1.71728 33.8545 0 0 -3 -1 24 1.71728 33.8545 0 -1 3 0 24 1.71728 33.8545 0 -1 0 3 24 1.71728 33.8545 0 -1 0 -3 24 1.71728 33.8545 0 -1 -3 0 24 1.71728 33.8545 0 -3 1 0 24 1.71728 33.8545 0 -3 0 1 24 1.71728 33.8545 0 -3 0 -1 24 1.71728 33.8545 0 -3 -1 0 24 1.71728 33.8545 0 3 1 1 24 1.63737 35.5607 527.63 3 1 -1 24 1.63737 35.5607 527.63 3 -1 1 24 1.63737 35.5607 527.63 3 -1 -1 24 1.63737 35.5607 527.63 1 3 1 24 1.63737 35.5607 527.63 1 3 -1 24 1.63737 35.5607 527.63 1 1 3 24 1.63737 35.5607 527.63 1 1 -3 24 1.63737 35.5607 527.63 1 -1 3 24 1.63737 35.5607 527.63 1 -1 -3 24 1.63737 35.5607 527.63 1 -3 1 24 1.63737 35.5607 527.63 1 -3 -1 24 1.63737 35.5607 527.63 -1 3 1 24 1.63737 35.5607 527.63 -1 3 -1 24 1.63737 35.5607 527.63 -1 1 3 24 1.63737 35.5607 527.63 -1 1 -3 24 1.63737 35.5607 527.63 -1 -1 3 24 1.63737 35.5607 527.63 -1 -1 -3 24 1.63737 35.5607 527.63 -1 -3 1 24 1.63737 35.5607 527.63 -1 -3 -1 24 1.63737 35.5607 527.63 -3 1 1 24 1.63737 35.5607 527.63 -3 1 -1 24 1.63737 35.5607 527.63 -3 -1 1 24 1.63737 35.5607 527.63 -3 -1 -1 24 1.63737 35.5607 527.63 2 2 2 8 1.56766 37.1985 1973.88 2 2 -2 8 1.56766 37.1985 1973.88 2 -2 2 8 1.56766 37.1985 1973.88 2 -2 -2 8 1.56766 37.1985 1973.88 -2 2 2 8 1.56766 37.1985 1973.88 -2 2 -2 8 1.56766 37.1985 1973.88 -2 -2 2 8 1.56766 37.1985 1973.88 -2 -2 -2 8 1.56766 37.1985 1973.88 3 2 0 24 1.50616 38.7768 0 3 0 2 24 1.50616 38.7768 0 3 0 -2 24 1.50616 38.7768 0 3 -2 0 24 1.50616 38.7768 0 2 3 0 24 1.50616 38.7768 0 2 0 3 24 1.50616 38.7768 0 2 0 -3 24 1.50616 38.7768 0 2 -3 0 24 1.50616 38.7768 0 0 3 2 24 1.50616 38.7768 0 0 3 -2 24 1.50616 38.7768 0 0 2 3 24 1.50616 38.7768 0 0 2 -3 24 1.50616 38.7768 0 0 -2 3 24 1.50616 38.7768 0 0 -2 -3 24 1.50616 38.7768 0 0 -3 2 24 1.50616 38.7768 0 0 -3 -2 24 1.50616 38.7768 0 -2 3 0 24 1.50616 38.7768 0 -2 0 3 24 1.50616 38.7768 0 -2 0 -3 24 1.50616 38.7768 0 -2 -3 0 24 1.50616 38.7768 0 -3 2 0 24 1.50616 38.7768 0 -3 0 2 24 1.50616 38.7768 0 -3 0 -2 24 1.50616 38.7768 0 -3 -2 0 24 1.50616 38.7768 0 3 2 1 48 1.45137 40.3028 0 3 2 -1 48 1.45137 40.3028 0 3 1 2 48 1.45137 40.3028 0 3 1 -2 48 1.45137 40.3028 0 3 -1 2 48 1.45137 40.3028 0 3 -1 -2 48 1.45137 40.3028 0 3 -2 1 48 1.45137 40.3028 0 3 -2 -1 48 1.45137 40.3028 0 2 3 1 48 1.45137 40.3028 0 2 3 -1 48 1.45137 40.3028 0 2 1 3 48 1.45137 40.3028 0 2 1 -3 48 1.45137 40.3028 0 2 -1 3 48 1.45137 40.3028 0 2 -1 -3 48 1.45137 40.3028 0 2 -3 1 48 1.45137 40.3028 0 2 -3 -1 48 1.45137 40.3028 0 1 3 2 48 1.45137 40.3028 0 1 3 -2 48 1.45137 40.3028 0 1 2 3 48 1.45137 40.3028 0 1 2 -3 48 1.45137 40.3028 0 1 -2 3 48 1.45137 40.3028 0 1 -2 -3 48 1.45137 40.3028 0 1 -3 2 48 1.45137 40.3028 0 1 -3 -2 48 1.45137 40.3028 0 -1 3 2 48 1.45137 40.3028 0 -1 3 -2 48 1.45137 40.3028 0 -1 2 3 48 1.45137 40.3028 0 -1 2 -3 48 1.45137 40.3028 0 -1 -2 3 48 1.45137 40.3028 0 -1 -2 -3 48 1.45137 40.3028 0 -1 -3 2 48 1.45137 40.3028 0 -1 -3 -2 48 1.45137 40.3028 0 -2 3 1 48 1.45137 40.3028 0 -2 3 -1 48 1.45137 40.3028 0 -2 1 3 48 1.45137 40.3028 0 -2 1 -3 48 1.45137 40.3028 0 -2 -1 3 48 1.45137 40.3028 0 -2 -1 -3 48 1.45137 40.3028 0 -2 -3 1 48 1.45137 40.3028 0 -2 -3 -1 48 1.45137 40.3028 0 -3 2 1 48 1.45137 40.3028 0 -3 2 -1 48 1.45137 40.3028 0 -3 1 2 48 1.45137 40.3028 0 -3 1 -2 48 1.45137 40.3028 0 -3 -1 2 48 1.45137 40.3028 0 -3 -1 -2 48 1.45137 40.3028 0 -3 -2 1 48 1.45137 40.3028 0 -3 -2 -1 48 1.45137 40.3028 0 4 0 0 6 1.35763 43.2202 1510.23 0 4 0 6 1.35763 43.2202 1510.23 0 0 4 6 1.35763 43.2202 1510.23 0 0 -4 6 1.35763 43.2202 1510.23 0 -4 0 6 1.35763 43.2202 1510.23 -4 0 0 6 1.35763 43.2202 1510.23 4 1 0 24 1.3171 44.6206 0 4 0 1 24 1.3171 44.6206 0 4 0 -1 24 1.3171 44.6206 0 4 -1 0 24 1.3171 44.6206 0 3 2 2 24 1.3171 44.6206 0 3 2 -2 24 1.3171 44.6206 0 3 -2 2 24 1.3171 44.6206 0 3 -2 -2 24 1.3171 44.6206 0 2 3 2 24 1.3171 44.6206 0 2 3 -2 24 1.3171 44.6206 0 2 2 3 24 1.3171 44.6206 0 2 2 -3 24 1.3171 44.6206 0 2 -2 3 24 1.3171 44.6206 0 2 -2 -3 24 1.3171 44.6206 0 2 -3 2 24 1.3171 44.6206 0 2 -3 -2 24 1.3171 44.6206 0 1 4 0 24 1.3171 44.6206 0 1 0 4 24 1.3171 44.6206 0 1 0 -4 24 1.3171 44.6206 0 1 -4 0 24 1.3171 44.6206 0 0 4 1 24 1.3171 44.6206 0 0 4 -1 24 1.3171 44.6206 0 0 1 4 24 1.3171 44.6206 0 0 1 -4 24 1.3171 44.6206 0 0 -1 4 24 1.3171 44.6206 0 0 -1 -4 24 1.3171 44.6206 0 0 -4 1 24 1.3171 44.6206 0 0 -4 -1 24 1.3171 44.6206 0 -1 4 0 24 1.3171 44.6206 0 -1 0 4 24 1.3171 44.6206 0 -1 0 -4 24 1.3171 44.6206 0 -1 -4 0 24 1.3171 44.6206 0 -2 3 2 24 1.3171 44.6206 0 -2 3 -2 24 1.3171 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