Tools

ALFchemY

Here, you can find various codes and utilities which can come in handy for simplifying computational workflows. Mostly written in bash and python script, make sure you have the latest versions of them installed.

MolPLACER 1.0

It provides the user with the capability of creating a dimer with custom interplanar distance, long-axis, and short-axis displacements. The precision of these parameters are important with properties such as short-range excitonic coupling and charge transport properties

Get the code!

AnisoMOB

Coming soon!!