Fedora 20 Update: cp2k-2.5-0.3.20131112svn13316.fc20
updates at fedoraproject.org
updates at fedoraproject.org
Thu Jan 2 22:01:52 UTC 2014
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Fedora Update Notification
FEDORA-2013-23954
2013-12-25 01:41:18
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Name : cp2k
Product : Fedora 20
Version : 2.5
Release : 0.3.20131112svn13316.fc20
URL : http://cp2k.org/
Summary : A molecular dynamics engine capable of classical and Car-Parrinello simulations
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 non-MPI single process and multi-threaded versions.
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Update Information:
Increase maximum angular momentum (BZ #1045781), but limit optimized one.
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ChangeLog:
* Tue Dec 24 2013 Susi Lehtola <jussilehtola at fedoraproject.org> - 2.5-0.3.20131112svn13316
- Rebuild against new libint.
* Fri Nov 15 2013 Dominik Mierzejewski <rpm at greysector.net> - 2.5-0.2.20131112svn13316
- use xz to compress SVN snapshot tarball
* Wed Nov 13 2013 Dominik Mierzejewski <rpm at greysector.net> - 2.5-0.1.20131112svn13316
- update to current SVN trunk
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References:
[ 1 ] Bug #1045781 - Can't run calculations with large basis sets
https://bugzilla.redhat.com/show_bug.cgi?id=1045781
[ 2 ] Bug #1037165 - libint FTBFS if "-Werror=format-security" flag is used
https://bugzilla.redhat.com/show_bug.cgi?id=1037165
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This update can be installed with the "yum" update program. Use
su -c 'yum update cp2k' at the command line.
For more information, refer to "Managing Software with yum",
available at http://docs.fedoraproject.org/yum/.
All packages are signed with the Fedora Project GPG key. More details on the
GPG keys used by the Fedora Project can be found at
https://fedoraproject.org/keys
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