- Name: cp2k-mpich
- Version: 2.3
- Release: 5.20130310svn12754.fc18
- Epoch:
- Group: Applications/Engineering
- License: GPLv2+
- Url: http://cp2k.org/
- Summary: Molecular simulations software - mpich version
- Architecture: i686
- Size: 22472972
- Distribution: Fedora Project
- Vendor: Fedora Project
- Packager: Fedora Project
Description:
CP2K is a freely available (GPL) program, written in Fortran 95, to
perform atomistic and molecular simulations of solid state, liquid,
molecular and biological systems. It provides a general framework for
different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
many-body potentials.
This package contains the multi-threaded version (using mpich).
- OptFlags: -O2 -g -pipe -Wall -Wp,-D_FORTIFY_SOURCE=2 -fexceptions -fstack-protector --param=ssp-buffer-size=4 -m32 -march=i686 -mtune=atom -fasynchronous-unwind-tables
- Cookie:
- Buildhost: buildvm-02.phx2.fedoraproject.org
