MoDeNa  1.0
Software framework facilitating sequential multi-scale modelling
Multicomponent Diffusion

Multicomponent Diffusion. More...

Multicomponent Diffusion.

README

MULTICOMPONENT DIFFUSION EXAMPLE:

Binary diffusion by Fuller etal. is combined with Wilke multicomponent diffusion.This example only shows the use of index sets. No backward mapping!

How to run?

Make sure PYTHONPATH and LD_LIBRARY_PATH are set

TODO:

Make this easier to use

export PKG_CONFIG_PATH=${PKG_CONFIG_PATH:-}:${HOME}/lib/pkgconfig:/usr/local/lib/pkgconfig export PYTHONPATH=${PYTHONPATH:-}:${HOME}/lib/python2.7/site-packages export LD_LIBRARY_PATH=${LD_LIBRARY_PATH:-}:${HOME}/lib/python2.7/site-packages:${HOME}/lib:/usr/local/lib

Compile project specific sources, i.e. "models":

fuller="../models/fullerEtAlDiffusion/src" cmake -H${fuller} -B${fuller} && make –directory=${fuller}

Initialise the model in the database

./initModel

Start the workflow

./workflow

Run again to see that no fitting is done on the second start

./workflow