CPMD

The CPMD code is a parallelized plane wave / pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio molecular dynamics.

Version: 4.3 (G100, MARCONI)

Availability: GALILEO100, MARCONI

Target: all

Official web site: http://cpmd.org

Related Commands:

Setup the environment with the command:

module load autoload cpmd

Help and Documentation:

You can find documentation on the system, with the command

module help cpmd

The manual is on the web at the original home page (http://cpmd.org)

CINECA consultants can be reached through the address: [email protected]