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B003_1Grain_GrowthFromLiquid.in
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#
# Automatic 'Driving File' written out by MICRESS.
#
#!======================================================================!
#! q_1Grain_GrowthFromLiquid
#!======================================================================!
#! 2D circular grain of phase 1 growing from liquid
#! (isothermal with constant undercooling of 0.2K).
#! Expected output in q_1D_Constant_Driving_Force.TabF:
#! last line:
#! 1.40000 999.00000 0.5+-0.03 0.5+- 0.03
#! Note: This is no real validation, cause the analytical description is still missing.
#!======================================================================!
#
#
# MICRESS binary
# ==============
# version number: 6.400 (Linux)
# compiled: 01/17/2018
# compiler version: Intel 1400 20140120
# executable architecture: x64
# Thermo-Calc coupling: enabled
# Version: 19
# Link Date: 20-03-2017 12:28:00
# OS Name: Linux
# Build Date: 10716
# Compiler: ifort (IFORT) 14.0.2 20140120
# OpenMP: disabled
# shell: /bin/tcsh
# ('double precision' binary)
#
#
# Language settings
# =================
# Please select a language: 'English', 'Deutsch' or 'Francais'
English
#
#
# Flags and settings
# ==================
#
# Geometry
# --------
# Grid size?
# (for 2D calculations: CellsY=1, for 1D calculations: CellsX=1, CellsY=1)
# Cells in X-direction (CellsX):
100
# Cells in Y-direction (CellsY):
1
# Cells in Z-direction (CellsZ):
100
# Cell dimension (grid spacing in micrometers):
# (optionally followed by rescaling factor for the output in the form of '3/4')
0.5
#
# Flags
# -----
# Type of coupling?
# Options: phase concentration [volume_change] temperature temp_cyl_coord
# [stress] [stress_coupled] [flow] [flow_coarse] [dislocation]
phase
# Type of potential?
# Options: double_obstacle multi_obstacle [fd_correction]
multi_obstacle fd_correction
#
# Phase field data structure
# --------------------------
# Coefficient for initial dimension of field iFace
# [minimum usage] [target usage]
0.20
# Coefficient for initial dimension of field nTupel
# [minimum usage] [target usage]
0.
#
#
# Restart options
# ===============
# Restart using old results?
# Options: new restart [reset_time | structure_only]
new
#
#
# Name of output files
# ====================
# Name of result files?
Results/B003_1Grain_GrowthFromLiquid
# Overwrite files with the same name?
# Options: overwrite write_protected append
# [zipped|not_zipped|vtk]
# [unix|windows|non_native]
overwrite
#
#
# Selection of the outputs
# ========================
# [legacy|verbose|terse]
# Finish selection of outputs with 'end_of_outputs'.
terse
out_fraction
tab_fractions
out_curvature
out_restart
out_grains
out_phases
tab_log 0.05
# out_interface ! [sharp]
# out_driv_force
# out_mobility
# out_velocity
# tab_grains ! [extra|standard]
# tab_vnm
# tab_grain_data
# out_temp
# out_recrystall
# tab_recrystall
# out_disloc
# out_miller
# out_orientation
# tab_orientation ! [rotmat]
end_of_outputs
#
#
# Time input data
# ===============
# Finish input of output times (in seconds) with 'end_of_simulation'
# 'regularly-spaced' outputs can be set with 'linear_step'
# or 'logarithmic_step' and then specifying the increment
# and end value
# ('automatic_outputs' optionally followed by the number
# of outputs can be used in conjuction with 'linear_from_file')
# 'first' : additional output for first time-step
# 'end_at_temperature' : additional output and end of simulation
# at given temperature
linear_step 0.2 1.4
end_of_simulation
# Time-step?
# Options: fix ...[s] automatic automatic_limited
automatic_limited
# Options: constant from_file
constant
# Limits: (real) min./s, [max./s], [phase-field factor], [segregation factor]
0.0 1000. 0.95
# Number of steps to adjust profiles of initially sharp interfaces [exclude_inactive]?
100
#
#
# Phase data
# ==========
# Number of distinct solid phases?
1
#
# Data for phase 1:
# -----------------
# Simulation of recrystallisation in phase 1?
# Options: recrystall no_recrystall [verbose|no_verbose]
no_recrystall
# Is phase 1 anisotrop?
# Options: isotropic anisotropic faceted_a faceted_b antifaceted
isotropic
# Should grains of phase 1 be reduced to categories?
# Options: categorize no_categorize
no_categorize
#
#
# Grain input
# ===========
# Type of grain positioning?
# Options: deterministic random [deterministic_infile] from_file
deterministic
# NB: the origin of coordinate system is the bottom left-hand corner,
# all points within the simulation domain having positive coordinates.
# Number of grains at the beginning?
1
# Input data for grain number 1:
# Geometry?
# Options: round rectangular elliptic round_inverse
round
# Center x,z coordinates [micrometers], grain number 1?
25.0000
25.0000
# Grain radius? [micrometers]
6.00000
# Shall grain 1 be stabilized or shall
# an analytical curvature description be applied?
# Options: stabilisation analytical_curvature
stabilisation
# Should the Voronoi criterion be applied?
# Options: voronoi no_voronoi
no_voronoi
# Phase number? (integer)
1
#
#
# Data for further nucleation
# ===========================
# Enable further nucleation?
# Options: nucleation nucleation_symm no_nucleation [verbose|no_verbose]
no_nucleation
#
#
# Phase interaction data
# ======================
#
# Data for phase interaction 0 / 1:
# ---------------------------------
# Simulation of interaction between phases 0 and 1?
# Options: phase_interaction no_phase_interaction
# [standard|particle_pinning[_temperature]|solute_drag]
# |[no_junction_force|junction_force]
phase_interaction no_junction_force
# Type of interfacial energy definition between phases 0 and 1?
# Options: constant temp_dependent
constant
# Interfacial energy between phases 0 and 1? [J/cm**2]
# [max. value for num. interface stabilisation [J/cm**2]]
1.0000E-05
# Type of mobility definition between phases 0 and 1?
# Options: constant temp_dependent dg_dependent [fixed_minimum]
constant
# Kinetic coefficient mu between phases 0 and 1 [ min. value ] [cm**4/(Js)] ?
1.E-03
#
# Data for phase interaction 1 / 1:
# ---------------------------------
# Simulation of interaction between phases 1 and 1?
# Options: phase_interaction no_phase_interaction identical phases nb
# [standard|particle_pinning[_temperature]|solute_drag]
# |[no_junction_force|junction_force]
no_phase_interaction
#
#
# Phase diagram - input data
# ==========================
# Equilibrium temperature [K] between 0 and 1
1000.00000000000
# Entropy of fusion between phase 0 and 1 ? [J/(cm**3 K)]
1.00000000000000
#
#
#
#
# Boundary conditions
# ===================
# Type of temperature trend?
# Options: linear linear_from_file profiles_from_file
linear
# Number of connecting points? (integer)
0
# Initial temperature at the bottom? (real) [K]
999.0000
# Temperature gradient in z-direction? [K/cm]
0.0000
# Cooling rate? [K/s]
0.0000
# Moving-frame system in z-direction?
# Options: moving_frame no_moving_frame
no_moving_frame
#
# Boundary conditions for phase field in each direction
# Options: i (insulation) s (symmetric) p (periodic/wrap-around)
# g (gradient) f (fixed) w (wetting)
# Sequence: W E (S N, if 3D) B T borders
iiiiii
# Unit-cell model symmetric with respect to the x/y diagonal plane?
# Options: unit_cell_symm no_unit_cell_symm
no_unit_cell_symm
#
#
# Other numerical parameters
# ==========================
# Phase minimum?
1.00E-4
# Interface thickness (in cells)?
5.00
#
#