nwchem 4.6 on SP4
Sigismondo Boschi
s.boschi a cineca.it
Lun 7 Feb 2005 14:22:17 CET
nwchem 4.6 is now available on SP4.
For more information type at the sp4 prompt:
module help nwchem
To use it and the subnwc script type:
module load nwchem
python support has not been included because compiling python at 64 bit
is troublesome.
--
Sigismondo Boschi, Ph.D. tel: +39 051 6171559
CINECA (High Performance Systems) fax: +39 051 6137273 - 6132198
via Magnanelli, 6/3 http://instm.cineca.it
40033 Casalecchio di Reno (BO)-ITALY http://www.cineca.it
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