CP2K¶
Note
SCARF is migrating to the SLURM batch system, instructions on this page which refer to LSF commands, parameters or configuration do not apply to SLURM. Please see our SLURM page for more information.
RHEL7 Modules:
CP2K/5.1-foss-2018a.lua
CP2K/5.1-intel-2017b.lua
CP2K/6.1-foss-2019a.lua
CP2K/8.2-foss-2021a.lua
CP2K/9.1-foss-2021a.lua
Description for CP2K:
CP2K is a quantum chemistry and solid state physics software package that can perform atomistic simulations of solid state, liquid, molecular, periodic, material, crystal, and biological systems.
Documentation for CP2K:
We don’t yet provide any specific documentation for this software, if you need assistance please contact the helpdesk.