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LOBSTER allows you to calculate projected COHP and COOP curves, and also reliable atom-projected DOS, directly based on plane-wave DFT output as given by the VASP or ABINIT or Quantum ESPRESSO packages.




Upcoming modulesystem change alert!

Due to large number of applications and their versions it is not practical to keep them explicitly listed at our wiki pages. Therefore an upgrade of modulefiles is underway. A feature of this upgrade will be the existence of default module for every application. This default choice does not need version number and it will load some (usually latest) version.

You can test the new version now by adding a line

source /cvmfs/software.metacentrum.cz/modulefiles/5.1.0/loadmodules

to your script before loading a module. Then, you can list all versions of logster and load default version of logster as

module avail logster/ # list available modules
module load logster   # load (default) module

If you wish to keep up to the current system, it is still possible. Simply list all modules by

module avail logster

and choose explicit version you want to use. Then run as

lobster-4.1.0 < input


See PDFs /software/lobster/4.1.0/Lobster_Users_Guide_4.1.0.pdf and /software/lobster/4.1.0/Lobster_FAQ_4.1.0.pdf