[2054] in Software_Announce
CPMD on Athena updated to 3.11.1
daemon@ATHENA.MIT.EDU (Alex T Prengel)
Mon Aug 14 17:29:13 2006
To: software-announce@mit.edu
cc: alexp@mit.edu, facdev@mit.edu, cfyi@mit.edu, trout@mit.edu,
marzari@mit.edu
Date: Mon, 14 Aug 2006 17:29:01 -0400
From: Alex T Prengel <alexp@MIT.EDU>
I've updated CPMD on Athena to 3.11.1 and made it the default. It's also now
available for Linux for the first time.
CPMD is a command-line application that can calculate a variety of
numeric quantities relevant to computational chemistry molecular dynamics.
Those of you interested in such an application should read text files
/afs/athena/software/cpmd/Athena/messages/upgradecpmd3.11.1 and
/afs/athena/software/cpmd_v3.11.1/README.athena for more information.
Alex
