xaim

Overview

Xaim (X Atoms in Molecules) is a graphical user interface to several programs based on some aspects of the Theory of Atoms in Molecules developed by Prof. R.F.W. Bader and coworkers.

Version 1.0 is installed on the CSF.

Restrictions on use

All users may access this software and use it for non-commerical purposes as per the README in the installation ($XAIM_HOME/README).

Set up procedure

To access the software you must first load the modulefile:

 module load apps/binapps/xaim/1.0

Running the application

Please do not run Xaim on the login node. After loading the modulefile please use qrsh to run the software:

qrsh -l inter -l short -V -cwd Xaim

Errors about ‘Cannot convert string’ and fonts can be ignored.

Further info

• Xaim websiteIncludes a user manual.

Updates

None.