python YAML is too picky/following v1.1
https://stackoverflow.com/questions/30458977
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7745640393
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@ -1,27 +1,27 @@
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TWIP_Steel_FeMnC:
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lattice: cF
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mechanical:
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elastic: {type: Hooke, C_11: 175.0e9, C_12: 115.0e9, C_44: 135.0e9}
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elastic: {type: Hooke, C_11: 175.0e+9, C_12: 115.0e+9, C_44: 135.0e+9}
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plastic:
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type: dislotwin
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output: [rho_mob, rho_dip, gamma_sl, Lambda_sl, tau_pass, f_tw, Lambda_tw, tau_hat_tw, f_tr]
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D: 2.0e-5
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N_sl: [12]
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b_sl: [2.56e-10]
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rho_mob_0: [1.0e12]
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rho_mob_0: [1.0e+12]
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rho_dip_0: [1.0]
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v_0: [1.0e4]
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v_0: [1.0e+4]
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Q_s: [3.7e-19]
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p_sl: [1.0]
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q_sl: [1.0]
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tau_0: [1.5e8]
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tau_0: [1.5e+8]
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i_sl: [10.0] # Adj. parameter controlling dislocation mean free path
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D_0: 4.0e-5 # Vacancy diffusion prefactor / m^2/s
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D_a: 1.0 # minimum dipole distance / b
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Q_cl: 4.5e-19 # Activation energy for climb / J
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h_sl-sl: [0.122, 0.122, 0.625, 0.07, 0.137, 0.137, 0.122] # Interaction coefficients (Kubin et al. 2008)
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# shear band parameters
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xi_sb: 180.0e6
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xi_sb: 180.0e+6
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Q_sb: 3.7e-19
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p_sb: 1.0
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q_sb: 1.0
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@ -1,19 +1,19 @@
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Tungsten:
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lattice: cI
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mechanical:
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elastic: {type: Hooke, C_11: 523.0e9, C_12: 202.0e9, C_44: 161.0e9} # Marinica et al. Journal of Physics: Condensed Matter(2013)
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elastic: {type: Hooke, C_11: 523.0e+9, C_12: 202.0e+9, C_44: 161.0e+9} # Marinica et al. Journal of Physics: Condensed Matter(2013)
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plastic:
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type: dislotwin
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D: 2.0e-5 # Average grain size / m
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N_sl: [12]
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b_sl: [2.72e-10] # Burgers vector length of slip families / m
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rho_mob_0: [1.0e12]
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rho_mob_0: [1.0e+12]
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rho_dip_0: [1.0]
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v_0: [1.0e4] # Initial glide velocity / m/s
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v_0: [1.0e+4] # Initial glide velocity / m/s
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Q_s: [2.725e-19] # Activation energy for dislocation glide / J
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p_sl: [0.78] # p-exponent in glide velocity
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q_sl: [1.58] # q-exponent in glide velocity
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tau_0: [1.5e8] # solid solution strength / Pa
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tau_0: [1.5e+8] # solid solution strength / Pa
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i_sl: [10.0] # Adj. parameter controlling dislocation mean free path
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D_0: 4.0e-5 # Vacancy diffusion prefactor / m^2/s
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D_a: 1.0 # minimum dipole distance / b
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@ -6,8 +6,8 @@ FreeSurface:
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plastic:
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type: isotropic
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output: [xi]
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xi_0: 0.3e6
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xi_inf: 0.6e6
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xi_0: 0.3e+6
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xi_inf: 0.6e+6
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dot_gamma_0: 0.001
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n: 5
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M: 3
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@ -4,14 +4,14 @@
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Martensite:
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lattice: cI
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mechanical:
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elastic: {C_11: 417.4e9, C_12: 242.4e9, C_44: 211.1e9, type: Hooke}
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elastic: {C_11: 417.4e+9, C_12: 242.4e+9, C_44: 211.1e+9, type: Hooke}
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plastic:
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N_sl: [12, 12]
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a_sl: 2.0
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dot_gamma_0_sl: 0.001
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h_0_sl-sl: 563.0e9
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h_0_sl-sl: 563.0e+9
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h_sl-sl: [1, 1.4, 1, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4]
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n_sl: 20
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type: phenopowerlaw
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xi_0_sl: [405.8e6, 456.7e6]
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xi_inf_sl: [872.9e6, 971.2e6]
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xi_0_sl: [405.8e+6, 456.7e+6]
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xi_inf_sl: [872.9e+6, 971.2e+6]
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@ -4,22 +4,22 @@ Magnesium:
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c/a: 1.62350
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mechanical:
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output: [F, P, F_e, F_p, L_p, O]
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elastic: {C_11: 59.3e9, C_12: 25.7e9, C_13: 21.4e9, C_33: 61.5e9, C_44: 16.4e9, type: Hooke}
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elastic: {C_11: 59.3e+9, C_12: 25.7e+9, C_13: 21.4e+9, C_33: 61.5e+9, C_44: 16.4e+9, type: Hooke}
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plastic:
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N_sl: [3, 3, 0, 6, 0, 6]
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N_tw: [6, 0, 0, 6]
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h_0_tw-tw: 50.0e6
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h_0_sl-sl: 500.0e6
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h_0_tw-sl: 150.0e6
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h_0_tw-tw: 50.0e+6
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h_0_sl-sl: 500.0e+6
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h_0_tw-sl: 150.0e+6
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h_sl-sl: [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1]
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h_tw-tw: [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1]
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h_sl-tw: [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1]
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h_tw-sl: [1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1]
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output: [xi_sl, xi_tw]
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type: phenopowerlaw
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xi_0_sl: [10.0e6, 55.0e6, 0, 60.0e6, 0.0, 60.0e6]
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xi_inf_sl: [40.0e6, 135.0e6, 0, 150.0e6, 0.0, 150.0e6]
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xi_0_tw: [40e6, 0.0, 0.0, 60.0e6]
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xi_0_sl: [10.0e+6, 55.0e+6, 0, 60.0e+6, 0.0, 60.0e+6]
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xi_inf_sl: [40.0e+6, 135.0e+6, 0, 150.0e+6, 0.0, 150.0e+6]
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xi_0_tw: [40e6, 0.0, 0.0, 60.0e+6]
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a_sl: 2.25
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dot_gamma_0_sl: 0.001
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dot_gamma_0_tw: 0.001
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@ -6,7 +6,7 @@ cpTi:
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c/a: 1.587
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mechanical:
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output: [F, P, F_e, F_p, L_p, O]
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elastic: {C_11: 160.0e9, C_12: 90.0e9, C_13: 66.0e9, C_33: 181.7e9, C_44: 46.5e9, type: Hooke}
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elastic: {C_11: 160.0e+9, C_12: 90.0e+9, C_13: 66.0e+9, C_33: 181.7e+9, C_44: 46.5e+9, type: Hooke}
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plastic:
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N_sl: [3, 3, 0, 6, 12]
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a_sl: 2.0
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@ -17,4 +17,4 @@ cpTi:
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output: [gamma_sl]
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type: phenopowerlaw
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xi_0_sl: [0.15e9, 0.09e9, 0, 0.20e9, 0.25e9]
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xi_inf_sl: [0.24e9, 0.5e9, 0, 0.6e9, 0.8e9]
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xi_inf_sl: [0.24e9, 0.5e+9, 0, 0.6e+9, 0.8e+9]
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@ -30,7 +30,7 @@ grid:
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eps_div_rtol: 5.0e-4 # relative tolerance for fulfillment of stress equilibrium
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eps_curl_atol: 1.0e-12 # absolute tolerance for fulfillment of strain compatibility
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eps_curl_rtol: 5.0e-4 # relative tolerance for fulfillment of strain compatibility
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eps_stress_atol: 1.0e3 # absolute tolerance for fulfillment of stress BC
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eps_stress_atol: 1.0e+3 # absolute tolerance for fulfillment of stress BC
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eps_stress_rtol: 0.01 # relative tolerance for fulfillment of stress BC
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eps_damage_atol: 1.0e-2 # absolute tolerance for damage evolution
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eps_damage_rtol: 1.0e-6 # relative tolerance for damage evolution
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@ -3,6 +3,6 @@ references:
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- J. Vallin et al.,
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Journal of Applied Physics 35(6), 1825-1826, 1964,
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10.1063/1.1713749
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C_11: 107.3e9
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C_12: 60.8e9
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C_44: 28.3e9
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C_11: 107.3e+9
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C_12: 60.8e+9
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C_44: 28.3e+9
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@ -1,6 +1,6 @@
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type: Hooke
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references:
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- www.mit.edu/~6.777/matprops/copper.htm, fixed typo
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C_11: 168.3e9
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C_12: 122.1e9
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C_44: 75.7e9
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C_11: 168.3e+9
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C_12: 122.1e+9
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C_44: 75.7e+9
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@ -5,5 +5,5 @@ references:
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John Wiley & Sons,
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page 837
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C_11: 242e9
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C_12: 146.5e9
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C_12: 146.5e+9
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C_44: 112e9
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@ -4,6 +4,6 @@ references:
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Theory of Dislocations, 1982,
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John Wiley & Sons,
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page 837
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C_11: 246.5e9
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C_12: 147.3e9
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C_44: 124.7e9
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C_11: 246.5e+9
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C_12: 147.3e+9
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C_44: 124.7e+9
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@ -3,8 +3,8 @@ references:
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- L. Wang et al.,
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Acta Materialia 132, 598-610, 2017,
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10.1016/j.actamat.2017.05.015
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C_11: 162.4e9
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C_33: 181.6e9
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C_44: 47.2e9
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C_11: 162.4e+9
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C_33: 181.6e+9
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C_44: 47.2e+9
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C_12: 92e9
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C_13: 69e9
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@ -3,6 +3,6 @@ references:
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- D. Cereceda et al.,
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International Journal of Plasticity, 78, 242-265, 2016,
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10.1016/j.ijplas.2015.09.002
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C_11: 523.e9
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C_12: 202.e9
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C_44: 161.e9
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C_11: 523.e+9
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C_12: 202.e+9
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C_44: 161.e+9
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@ -8,9 +8,9 @@ references:
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output: [rho_dip, rho_mob]
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N_sl: [12, 12]
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b_sl: [2.49e-10, 2.49e-10]
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rho_mob_0: [2.81e12, 2.8e12]
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rho_mob_0: [2.81e12, 2.8e+12]
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rho_dip_0: [1.0, 1.0] # not given
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v_0: [1.4e3, 1.4e3]
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v_0: [1.4e+3, 1.4e+3]
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Q_s: [1.57e-19, 1.57e-19] # Delta_F
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tau_0: [454e6, 454e6]
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p_sl: [0.325, 0.325]
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@ -32,7 +32,7 @@ w: 10 # w_k in multiple of b
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p_sl: 1
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q_sl: 1
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nu_a: 50.e9
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nu_a: 50.e+9
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B: 1.e-2
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f_ed: 1.0 # k_3
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@ -13,10 +13,10 @@ d_sc: [12.e-9]
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i_sl: [45] # k_2
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f_ed_mult: 0.1 # k_1
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rho_u_ed_neg_0: [6.e10] # 2.88e12 / (12*4)
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rho_u_ed_pos_0: [6.e10] # 2.88e12 / (12*4)
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rho_u_sc_neg_0: [6.e10] # 2.88e12 / (12*4)
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rho_u_sc_pos_0: [6.e10] # 2.88e12 / (12*4)
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rho_u_ed_neg_0: [6.e+10] # 2.88e12 / (12*4)
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rho_u_ed_pos_0: [6.e+10] # 2.88e12 / (12*4)
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rho_u_sc_neg_0: [6.e+10] # 2.88e12 / (12*4)
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rho_u_sc_pos_0: [6.e+10] # 2.88e12 / (12*4)
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rho_d_ed_0: [0]
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rho_d_sc_0: [0]
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@ -32,7 +32,7 @@ w: 10 # w_k
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p_sl: 1
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q_sl: 1
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nu_a: 50.e9
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nu_a: 50.e+9
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B: 1.e-3
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f_ed: 0.01 # k_3
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@ -8,8 +8,8 @@ output: [xi_sl, gamma_sl]
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N_sl: [12]
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n_sl: 20
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a_sl: 3.1
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h_0_sl-sl: 1.7e8
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xi_0_sl: [5.0e6]
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xi_inf_sl: [37.5e6]
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h_0_sl-sl: 1.7e+8
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xi_0_sl: [5.0e+6]
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xi_inf_sl: [37.5e+6]
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h_sl-sl: [1, 1, 1.4, 1.4, 1.4, 1.4, 1.4]
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dot_gamma_0_sl: 4.5e-3
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@ -10,8 +10,8 @@ output: [xi_sl, gamma_sl]
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N_sl: [12]
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n_sl: 83.3
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a_sl: 1.0
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h_0_sl-sl: 75.0e6
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h_0_sl-sl: 75.0e+6
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xi_0_sl: [26.25e6]
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xi_inf_sl: [53.0e6]
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xi_inf_sl: [53.0e+6]
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h_sl-sl: [1, 1, 1.4, 1.4, 1.4, 1.4, 1.4]
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dot_gamma_0_sl: 0.001
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@ -8,8 +8,8 @@ output: [xi_sl, gamma_sl]
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N_sl: [12]
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n_sl: 20
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a_sl: 1.0
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h_0_sl-sl: 2.4e8
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xi_0_sl: [1.5e6]
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xi_inf_sl: [112.5e6]
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h_0_sl-sl: 2.4e+8
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xi_0_sl: [1.5e+6]
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xi_inf_sl: [112.5e+6]
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h_sl-sl: [1, 1, 1.4, 1.4, 1.4, 1.4, 1.4]
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dot_gamma_0_sl: 3e-3
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@ -7,8 +7,8 @@ output: [xi_sl, gamma_sl]
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N_sl: [12, 12]
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n_sl: 20
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a_sl: 2.25
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h_0_sl-sl: 1.0e9
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xi_0_sl: [95.e6, 96.e6]
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xi_inf_sl: [222.e6, 412.e6]
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h_0_sl-sl: 1.0e+9
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xi_0_sl: [95.e+6, 96.e+6]
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xi_inf_sl: [222.e+6, 412.e+6]
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h_sl-sl: [1, 1.4, 1, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4, 1.4]
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dot_gamma_0_sl: 0.001
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