diff --git a/examples/config/Phase_Dislotwin_TWIP-Steel-FeMnC.yaml b/examples/config/Phase_Dislotwin_TWIP-Steel-FeMnC.yaml index 6c19b9f93..e0f9e4cc9 100644 --- a/examples/config/Phase_Dislotwin_TWIP-Steel-FeMnC.yaml +++ b/examples/config/Phase_Dislotwin_TWIP-Steel-FeMnC.yaml @@ -1,31 +1,62 @@ type: dislotwin -output: [rho_mob, rho_dip, gamma_sl, Lambda_sl, tau_pass, f_tw, Lambda_tw, tau_hat_tw, f_tr] -D: 2.0e-5 +output: [rho_mob, rho_dip, gamma_sl, Lambda_sl, tau_pass, f_tw, Lambda_tw, f_tr] + +# Slip N_sl: [12] b_sl: [2.56e-10] +Q_sl: [3.5e-19] +p_sl: [0.325] +q_sl: [1.55] +B: [0.001] +i_sl: [30.0] + rho_mob_0: [1.0e+12] rho_dip_0: [1.0] + v_0: [1.0e+4] -Q_sl: [3.7e-19] -p_sl: [1.0] -q_sl: [1.0] -tau_0: [1.5e+8] -i_sl: [10.0] # Adj. parameter controlling dislocation mean free path -D_0: 4.0e-5 # Vacancy diffusion prefactor / m^2/s +tau_0: [3.5e+8] D_a: 1.0 # minimum dipole distance / b Q_cl: 4.5e-19 # Activation energy for climb / J + h_sl-sl: [0.122, 0.122, 0.625, 0.07, 0.137, 0.137, 0.122] # Interaction coefficients (Kubin et al. 2008) -# twinning parameters +h_tw-sl: [0.0] # ToDo: values not known + +# Twin N_tw: [12] -b_tw: [1.47e-10] # Burgers vector length of twin system / b -t_tw: [5.0e-8] # Twin stack mean thickness / m -L_tw: 442.0 # Length of twin nuclei / b -x_c_tw: 1.0e-9 # critical distance for formation of twin nucleus / m -V_cs: 1.67e-29 # cross slip volume / m^3 -p_tw: [10.0] # r-exponent in twin formation probability -i_tw: 1.0 # Adj. parameter controlling twin mean free path -h_sl-tw: [0.0, 1.0, 1.0] # dislocation-twin interaction coefficients -h_tw-tw: [0.0, 1.0] # twin-twin interaction coefficients -T_ref: 0.0 -Gamma_sf: -0.0396 # stacking fault energy / J/m^2 at zero K; TWIP steel: -0.0526; Cu: -0.0396 -Gamma_sf,T: 0.0002 # temperature dependence / J/(m^2 K) of stacking fault energy +b_tw: [1.40e-10] +L_tw: 2.e-7 # 800 b_sl +i_tw: 10.0 +t_tw: [5.0e-8] +p_tw: [2.5] # A + +h_tw-tw: [0.0, 1.0] # ToDo: values not known +h_sl-tw: [0.0, 1.0, 1.0] # ToDo: values not known + +# Transformation +N_tr: [12] +b_tr: [1.40e-10] +L_tr: 2.e-7 # 800 b_sl +i_tr: 3.0 +t_tr: [1.0e-7] +p_tr: [2.5] # B +V_mol: 7.09e-6 +Delta_G: 1.33343932e+02 +Delta_G,T: 2.56640412 +Delta_G,T^2: 1.49524179e-03 + +h_tr-tr: [1.0, 1.0] # guessing +h_sl-tr: [0.0, 1.0, 1.0] # guessing + +# Twin & Transformation +T_ref: 298.15 +Gamma_sf: 2.89394017e-02 +Gamma_sf,T: 1.22823814e-04 +Gamma_sf,T^2: 1.47322968e-07 +x_c: 1.0e-9 +V_cs: 1.67e-29 + +a_cF: 3.62e-10 +c/a_hP: 1.633 + +# Slip & Twin & Transformation +D: 2.0e-5