The Graphical User Interface for ADF (ADF-GUI)

The modules in the graphical user interface (ADF-GUI) are coupled in convenient ways. Clicking on a peak in an IR spectrum start a movie of the corresponding vibrational mode. Selecting an energy level shows a picture of the associated molecular orbital. Step-by-step tutorials ensure that anyone can visualize results of basis ADF calculations within an hour after installation.
The ADF-GUI currently contains the following modules (click on an image to get a bigger picture):

ADFinput Draw or import your molecule, choose the desired options from menu's, and start up your ADF calculation			ADFjobs Manage ADF calculations: run jobs locally and remotely, keep track of running jobs. Convenient launcher of other modules.
ADFview Visualize 3d data fields for orbitals, densities, potentials, etc. Rotate pictures interactively, add cut planes, combine fields, export pictures in standard file formats.			ADFmovie Shows normal mode vibrations or a movie of steps in a geometry optimization or transition state search.
ADFspectra Visualize IR, Raman, VCD, CD, MCD, or UV/Vis spectra, and get detailed information about selected peak, view corresponding vibration modes or molecular orbitals.			ADFlevels Draw interaction diagram which shows which fragment orbitals contribute to the energy levels in the molecule.
ADFtail Shows a summary of the progress of an ADF calculation. ADFprep Prepare (multiple) ADF jobs (Tool of ADFjobs) ADFreport Generate a report (Tool of ADFjobs)			ADFdos Shows (partial) Density-of-States graphs. ADFoutput Enables you to quickly find the detail information of interest in the full ASCII output file. GUIprefs Change preferences used by the ADF-GUI.

Links

More ADF-GUI screenshots ...
ADFGUI: tutorial, reference manual, quick reference manual