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ALFchemY

Tools

Here, you can find various codes and utilities which can come in handy for simplifying computational workflows. Mostly written in bash and python!

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MolPLACER 1.1

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

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BLENDPLOT

Utilizing the power of blender 2.9 for rendering 3D data plots, combined with the python interface!

WORK IN PROGRESS