Installation¶
Installing CatINT¶
CatINT is a program package which combines mass transport simulations with micro- kinetic modeling. Installing CatINT requires:
- python 2.5 or greater
- numpy
- scipy
- matplotlib
- tables
- logging
After installing all dependencies, you can install CatINT into a folder $CATINT via:
$ mkdir $CATINT
$ cd $CATINT
$ git clone git@github.com:sringe/CatINT.git
As usual update your $PYTHONPATH variable with the $CATINT folder location and verify that everything worked by importing the central transport module of CatINT:
$ python >>>from catint import transport
Installing CatMAP¶
For installing CatMAP, please see https://catmap.readthedocs.io/en/latest/installation.html.
For running CatMAP with CatINT, it is required to download the version from https://github.com/sringe/catmap-1.git, which enables the Frumkin voltage corrections and surface charge corrections of energetics which are not yet contained in the main repository.
Installing COMSOL¶
For installing COMSOL ®, please see www.comsol.de. CatiNT writes a java input file
for COMSOL ® which is then compiled and executed. The COMSOL ® executable location
is automatically searched for. However, if this fails, or the executable is out of reach for
the `locate`
linux command, specify the path of the executable manually in the `tp.comsol_args['bin_path']`
variable (where `tp`
is an instance of the `Transport`
class).
Documentation (this wiki) is located in the catmap/docs folder, and is available online at http://catint.readthedocs.org/.