Compiling NWChem

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Thread Title	Replies	Views	Last Action
Trouble compiling NWChem with python support	4	3064	Jun 11th 4:16 pm Mernst
compile nwchem-6-3 with openmpi1.6.5 & ifort	9	5475	Jun 6th 5:20 pm Mernst
How to compile and run NWCHEM 6.3 in parallel mode on MAC OS X?	2	1736	Jun 4th 8:08 am Huub
nproc always 4	1	1815	May 30th 8:40 am WillEverett
odd DFT-BSSE energy output...	6	4453	May 29th 6:43 am Neo
Compiling NWChem 6.3 on Cray XC30 (ARCHER) with Intel	3	1831	May 22nd 1:43 am Twk
Why the unilization ratio of CPU is more than 100% in the running process of nwchem?	4	2532	May 21st 12:15 am Gvtheen
Running with OpenMPI on multiple nodes failing	8	7996	May 19th 2:13 am Gvtheen
error compiling nwchem 6.3 May 2014 version released	7	1766	May 13th 11:18 pm Avelon
NWchem 6.3 compile problems with Intel compilers: ics-2013.0.028	4	5291	May 8th 10:34 am WillEverett
naming convention of the tarball	5	2266	May 7th 9:52 pm Huub
official RPMS for RHEL6 and Fedora >=19: feedback needed	3	4297	May 6th 9:25 am Marcindulak
a new user of nwchem, several issue for help!!	4	2267	Apr 26th 5:39 pm Bsmile
Request for building script for a IBM Power7 AIX 6.1 Systems	1	2360	Apr 24th 1:19 pm Edoapra
Compiling NWChem 6.3 on BlueGene/Q	5	2379	Apr 16th 1:52 pm Huub
Enabling TCE_CUDA	1	2338	Apr 15th 4:48 pm Huub
Compiling NWChem with VampirTrace on Titan	1	1643	Apr 10th 4:11 pm Huub
nwchem-6.3 in cygwin	1	1682	Apr 8th 2:00 pm Huub
Building Nwchem against a separate GA library	2	1783	Mar 7th 1:13 pm Marcindulak
Error: name chosen for NWCHEM_TOP is longer than ...	1	29809	Feb 27th 1:54 pm Edoapra
Compiling NWChem 6.3 with Myrinet MX	7	1700	Feb 20th 10:33 am Edoapra
Compiling on Cray XE6/XE7	3	2511	Feb 14th 2:39 pm Edoapra
Nwchem-src-2014-01-28 broken on Fedora 20 x86_64	8	3459	Feb 9th 7:21 am Marcindulak
Compiling error in geom_hnd.F	2	2346	Feb 7th 10:16 am Gmatthias.ullmann
problem with task scf	3	2056	Jan 31st 9:33 pm Lovi
Using prebuild GA with NWchem 6.3	1	1631	Jan 24th 6:08 pm Edoapra

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