Compiling NWChem


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bse.pnl.gov replaced by www.basissetexchange.org. BSE forum closed
 0 9997 Jun 7th 4:53 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
 0 12336 Dec 14th 2:51 pm
Edoapra

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Why the unilization ratio of CPU is more than 100% in the running process of nwchem?
 4 2377 May 21st 12:15 am
Gvtheen
Running with OpenMPI on multiple nodes failing
 8 7838 May 19th 2:13 am
Gvtheen
error compiling nwchem 6.3 May 2014 version released
 7 1718 May 13th 11:18 pm
Avelon
NWchem 6.3 compile problems with Intel compilers: ics-2013.0.028
 4 5192 May 8th 10:34 am
WillEverett
naming convention of the tarball
 5 2170 May 7th 9:52 pm
Huub
official RPMS for RHEL6 and Fedora >=19: feedback needed
 3 4196 May 6th 9:25 am
Marcindulak
a new user of nwchem, several issue for help!!
 4 2206 Apr 26th 5:39 pm
Bsmile
Request for building script for a IBM Power7 AIX 6.1 Systems
 1 2279 Apr 24th 1:19 pm
Edoapra
Compiling NWChem 6.3 on BlueGene/Q
 5 2291 Apr 16th 1:52 pm
Huub
Enabling TCE_CUDA
 1 2240 Apr 15th 4:48 pm
Huub
Compiling NWChem with VampirTrace on Titan
 1 1578 Apr 10th 4:11 pm
Huub
nwchem-6.3 in cygwin
 1 1604 Apr 8th 2:00 pm
Huub
Building Nwchem against a separate GA library
 2 1696 Mar 7th 1:13 pm
Marcindulak
Error: name chosen for NWCHEM_TOP is longer than ...
 1 29756 Feb 27th 1:54 pm
Edoapra
Compiling NWChem 6.3 with Myrinet MX
 7 1659 Feb 20th 10:33 am
Edoapra
Compiling on Cray XE6/XE7
 3 2439 Feb 14th 2:39 pm
Edoapra
Nwchem-src-2014-01-28 broken on Fedora 20 x86_64
 8 3372 Feb 9th 7:21 am
Marcindulak
Compiling error in geom_hnd.F
 2 2287 Feb 7th 10:16 am
Gmatthias.ullmann
problem with task scf
 3 2005 Jan 31st 9:33 pm
Lovi
Using prebuild GA with NWchem 6.3
 1 1573 Jan 24th 6:08 pm
Edoapra
compile NWChem 6.3 with intel scalapack - segmentation fault
 1 2186 Jan 20th 6:16 pm
Edoapra
problem with compiling on MacOs
 7 2467 Jan 15th 12:48 pm
Edoapra
NWChem for Large systems
 3 2371 Jan 8th 3:33 pm
Edoapra
compiling NWChem 6.3
 3 2954 Dec 17th 10:22 am
Edoapra
Problem compiling NWChem on CYGWIN
 1 1909 Dec 9th 3:07 pm
Huub

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