Compiling NWChem

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups	0	1715	Jun 18th 5:01 pm Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload	0	13620	Dec 14th 2:51 pm Edoapra

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Thread Title	Replies	Views	Last Action
nproc always 4	1	1814	May 30th 8:40 am WillEverett
odd DFT-BSSE energy output...	6	4452	May 29th 6:43 am Neo
Compiling NWChem 6.3 on Cray XC30 (ARCHER) with Intel	3	1830	May 22nd 1:43 am Twk
Why the unilization ratio of CPU is more than 100% in the running process of nwchem?	4	2531	May 21st 12:15 am Gvtheen
Running with OpenMPI on multiple nodes failing	8	7995	May 19th 2:13 am Gvtheen
error compiling nwchem 6.3 May 2014 version released	7	1765	May 13th 11:18 pm Avelon
NWchem 6.3 compile problems with Intel compilers: ics-2013.0.028	4	5290	May 8th 10:34 am WillEverett
naming convention of the tarball	5	2265	May 7th 9:52 pm Huub
official RPMS for RHEL6 and Fedora >=19: feedback needed	3	4296	May 6th 9:25 am Marcindulak
a new user of nwchem, several issue for help!!	4	2266	Apr 26th 5:39 pm Bsmile
Request for building script for a IBM Power7 AIX 6.1 Systems	1	2359	Apr 24th 1:19 pm Edoapra
Compiling NWChem 6.3 on BlueGene/Q	5	2378	Apr 16th 1:52 pm Huub
Enabling TCE_CUDA	1	2337	Apr 15th 4:48 pm Huub
Compiling NWChem with VampirTrace on Titan	1	1642	Apr 10th 4:11 pm Huub
nwchem-6.3 in cygwin	1	1681	Apr 8th 2:00 pm Huub
Building Nwchem against a separate GA library	2	1782	Mar 7th 1:13 pm Marcindulak
Error: name chosen for NWCHEM_TOP is longer than ...	1	29808	Feb 27th 1:54 pm Edoapra
Compiling NWChem 6.3 with Myrinet MX	7	1699	Feb 20th 10:33 am Edoapra
Compiling on Cray XE6/XE7	3	2510	Feb 14th 2:39 pm Edoapra
Nwchem-src-2014-01-28 broken on Fedora 20 x86_64	8	3458	Feb 9th 7:21 am Marcindulak
Compiling error in geom_hnd.F	2	2345	Feb 7th 10:16 am Gmatthias.ullmann
problem with task scf	3	2055	Jan 31st 9:33 pm Lovi
Using prebuild GA with NWchem 6.3	1	1630	Jan 24th 6:08 pm Edoapra
compile NWChem 6.3 with intel scalapack - segmentation fault	1	2254	Jan 20th 6:16 pm Edoapra
problem with compiling on MacOs	7	2530	Jan 15th 12:48 pm Edoapra
NWChem for Large systems	3	2446	Jan 8th 3:33 pm Edoapra

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