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mml:pdc-setup

Setting up the cluster environment at PDC

Note: The following text (and most of the materials modelling lab wiki) assume that you are fairly proficient in using the unix command line and the bash shell. If you are not, please first refer to basics for some pointers and links that may be helpful for learning these skills.

Necessary modules and initfiles

< WIKI-TODO: Explain what modules, etc. to typically include in .bashrc. >

VASP

< WIKI-TODO: Add details about what is needed to get access to VASP, which modules to use >

EMTO

< WIKI-TODO: Add details about what is needed to get access to EMTO code, which modules to use >

mml/pdc-setup.txt · Last modified: 2012-12-07 14:56 by rar