!* Fe-Cr-Ni alpha+gamma diffusion couple
!* See Larsson, Engström, Acta Materialia 54(2006)2431-2439


!*YAPFI macro
!*-----------
SET_NUMBER_OF_THREADS
4!Number of threads /1/


MANDATORY_DATA
fecrni_bcc_fcc_demo.GES5!GES file / ANALYTICAL [<analytic init file>]
1373.15!(Initial) Temperature [K] /1000.0000/
!Pressure [Pa] /100000.00/
!Element CR substitutional /YES/
!Element FE substitutional /YES/
!Element NI substitutional /YES/
!Initially homogeneous composition /YES/
0.2572!Initial mole fraction of element CR
0.6781!Initial mole fraction of element FE
0.0647!Initial mole fraction of element NI
!*Enter state of phases, 1:Entered, 2: Suspended
!State of phase (BCC_A2) /1/
!State of phase (FCC_A1) /1/
!Dimensionality /1/
60!Nr of grid points in dimension #1 /10/
3e-3!Domain width [m] in dimension #1 /1.0000000/
!Periodic boundary in dimension #1 /NO/
!*Grid type. 1:Linear, 2:Geometric, 3: Double geometric, 4: Read from file
3!Grid type in dimension #1 /1/
!*In dimension #1
0.85!Lower geometric factor /1.0000000/
1.15!Upper geometric factor /1.0000000/
!*Info: Initial time is always zero
3.6e5!Simulation time [s] /1.0000000/
!Maximum timestep [s] /36000.000/
!Minimum timestep [s] /0.10000000E-09/
!Initial timestep [s] /0.10000000E-09/
!Save interval /1/
!Minimum elapsed time between saves [f(time)], [s] /1.0/

INHOMOGENEITY
!*Inhomogeneity options:
!*1.segment/circle/sphere
!*2.Segment/triangle/tetrahedron at origin
!*3.Arbitrary segment/triangular/tetrahedron
!*Enter a non-valid option to exit command
1!Inhomogeneity option
3e-3!Enter center coordinate in spatial dimension #1
1.5e-3!Enter radius
!Relative grid fineness around inhomogeneity (only relevant with adaptive meshing) /0/
0.4231!Mole fraction of element CR
0.3014!Mole fraction of element FE
0.2755!Mole fraction of element NI

TQ_SETTINGS
!Use interpolation scheme /YES/
!Discretization type (1=linear, 2=logarithmic) /2/
!Log of nr of steps /3/
!Memory fraction /100.00000/
!Global minimization allowed /YES/
!Use global minimization /NO/
!Use forced starting values /NO/
!Default numerical settings for TQ /YES/

HOMOGENIZATION_FUNCTION
!*Homogenization functions:
!*1. Rule-of-mixtures
!*2. Rule-of-mixtures with the phase volume fraction squared
!*3. Rule-of-mixtures with the phase volume fraction squared and prescribed matrix phase
!*4. Rule-of-mixtures with prescribed matrix phase
!*5. Arbitrary exponent labyrinth function. Prescribed matrix phase.
!*6. Function of volume fraction fraction of prescribed phase (labyrinth function)
!*7. Phase fraction weighted geometric mean of stable phases
1!Homogenization function /1/

IDEAL_FLUX_CONTRIBUTION
y!Use ideal flux contribution /NO/
0.01!Ideal flux factor /0.10000000E-01/


