The Graphical User Interface for BAND (BAND-GUI)

The ADF2007 release of the graphical user interface for BAND (BAND-GUI) now includes a crystal and surface builder and supports geometry optimization. Further improvement of the current BAND-GUI modules and development of additional modules is a high priority for SCM. A step-by-step tutorial ensures that anyone can visualize results of a basis BAND calculation within an hour after installation.
The BAND-GUI currently contains the following modules (click on an image to get a bigger picture):

BANDinput
Draw or import the atoms in the unit cell, choose the desired options from menu's, and start up your BAND calculation
ADFjobs
Manage BAND calculations: run jobs locally and remotely, keep track of running jobs. Convenient launcher of other modules.
ADFview
Visualize 3d data fields for orbitals and deformation density. Rotate pictures interactively, add cut planes, combine fields, export pictures in standard file formats.
BANDstructure
Shows plot of the electronic band structure.
ADFtail
Shows a summary of the progress of a BAND calculation.
BOB
Enables you to quickly find the detail information of interest in the full ASCII output file.

Links

BAND-GUI: tutorial, reference manual

 

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