Compiling NWChem

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Announcement's	Replies	Views	Last Action
Sticky: Beta version of NWChem 6.6 available for download Started By : Edoapra	2	222	Sep 30th 10:14 am Edoapra
NWChem 6.5 has been released Started By : Karol	0	9001	Sep 15th 11:02 am Karol

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Thread Title	Replies	Views	Last Action
Instructions in the manual cannot set modules and define target Started By : Xiongyan21	10	946	Jul 9th 6:47 am Xiongyan21
Problem with Compilation on Intel Xeon 5670, GNU/Linux CentOS 5 x86_64 Started By : Yulia	1	582	Jul 8th 11:59 am Edoapra
NWCHEM 6.1.1 on MIC node Started By : Hkikuchi	3	698	Jul 2nd 2:40 pm Hkikuchi
Making libraries in tools fails when compiling Nwchem6.3 revision2 on MAC Started By : Xiongyan21	0	684	Jun 26th 8:19 pm Xiongyan21
GA failing to compile in NWChem6.1.1 Started By : WillEverett	0	413	Jun 26th 1:24 pm WillEverett
Cannot Define NWCHEM_TOP in the Chosen Directory Started By : Xiongyan21	1	564	Jun 26th 12:32 am Mernst
error compiling nwchem 6.3 last version released1 2 Started By : Lorenzodona	16	3756	Jun 25th 11:26 am Obm
Compiling nwchem-6.3 in a contemporary HPC with Xeon PHI Started By : Obm	14	1210	Jun 23rd 2:48 pm Mernst
install nwchem Started By : Marcel	1	1562	Jun 13th 6:58 am Marcel
Trouble compiling NWChem with python support Started By : Jwkeller	4	882	Jun 11th 4:16 pm Mernst
compile nwchem-6-3 with openmpi1.6.5 & ifort Started By : Yury	9	1550	Jun 6th 5:20 pm Mernst
How to compile and run NWCHEM 6.3 in parallel mode on MAC OS X? Started By : Xiongyan21	2	588	Jun 4th 8:08 am Huub
nproc always 4 Started By : WillEverett	1	580	May 30th 8:40 am WillEverett
odd DFT-BSSE energy output... Started By : Neo	6	1774	May 29th 6:43 am Neo
Compiling NWChem 6.3 on Cray XC30 (ARCHER) with Intel Started By : Twk	3	684	May 22nd 1:43 am Twk
Why the unilization ratio of CPU is more than 100% in the running process of nwchem? Started By : Gvtheen	4	782	May 21st 12:15 am Gvtheen
Running with OpenMPI on multiple nodes failing Started By : Pabugeater	8	1619	May 19th 2:13 am Gvtheen
error compiling nwchem 6.3 May 2014 version released Started By : Avelon	7	788	May 13th 11:18 pm Avelon
NWchem 6.3 compile problems with Intel compilers: ics-2013.0.028 Started By : Crookscj	4	2375	May 8th 10:34 am WillEverett
naming convention of the tarball Started By : Marcindulak	5	939	May 7th 9:52 pm Huub
official RPMS for RHEL6 and Fedora >=19: feedback needed Started By : Marcindulak	3	1819	May 6th 9:25 am Marcindulak
a new user of nwchem, several issue for help!! Started By : Bsmile	4	1002	Apr 26th 5:39 pm Bsmile
Request for building script for a IBM Power7 AIX 6.1 Systems Started By : Chiensh	1	802	Apr 24th 1:19 pm Edoapra
Compiling NWChem 6.3 on BlueGene/Q Started By : Twk	5	1014	Apr 16th 1:52 pm Huub
Enabling TCE_CUDA Started By : Nino	1	558	Apr 15th 4:48 pm Huub

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