Compiling NWChem

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Announcement's Replies Views Last Action
Third release candidate for NWChem 6.8 available
Started By : Edoapra
7 348 Dec 3rd 3:06 pm
Edoapra
Bug in Raman code
Started By : Sean
0 2048 Feb 2nd 5:45 pm
Sean
NWChem 6.6: bug in geometry optimization
Started By : Edoapra
5 2177 Jan 28th 1:50 pm
Edoapra
Sticky: NWChem 6.6 available for download
Started By : Edoapra
0 5664 Oct 20th 3:12 pm
Edoapra

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Thread Title Replies Views Last Action
Having Issue Compiling Nwchem 6.3
Started By : Neo
9 1841 Sep 13th 5:58 am
Edoapra
Nwchem 6.3 checking whether a simple Fortran MPI program compiles... no
Started By : Reoverstreet
5 4339 Sep 13th 5:49 am
Edoapra
A bug in compiling nwchem 6.5
Started By : Hajiabadi
4 1200 Sep 11th 9:09 am
Hajiabadi
GNU make 3.82 issue
Started By : Kernelpanic
10 5502 Sep 9th 4:15 am
Neo
Issues compiling NWChem 6.0
Started By : Cuevasr
5 941 Sep 7th 9:49 pm
Edoapra
"No such file or directory" during compilling NWCHEM 6.3 REV 2 or NWCHEM 6.1.1 ON MAC
Started By : Xiongyan21
1 1280 Sep 5th 8:12 am
Edoapra
Re: Beta version of NWChem 6.5 available for testing
Started By : Mpjohans
4 1288 Sep 4th 3:32 pm
Edoapra
compile nwchem-6-3.revision2-src.2013-10-17 with openmpi-1.6.4 on Ubuntu x86_64 GNU/Linux
Started By : Himadride
1 1329 Sep 2nd 5:21 pm
Edoapra
Compiling latest nwchem latest snapshot without mpi
Started By : Cmjohns6
3 1013 Sep 2nd 8:44 am
Edoapra
HOWTO: compiling nwchem-6.5 beta on Ubuntu 14.04 x86-64
Started By : Mernst
4 6131 Aug 29th 5:44 pm
Mernst
compilation problem
Started By : Clusterix
3 3513 Aug 26th 8:20 am
Edoapra
Building 6.3 with gcc/CentOS 5, fails with error: �DLAMCHE� undeclared
Started By : Djennewe
1 1521 Aug 19th 10:18 am
Edoapra
how do I set the path to python library for nwchem
Started By : Jtande
7 3928 Jul 31st 7:07 am
Jtande
error during compilation Nwchem-dev.revision25716-src.2014-06-09
Started By : Marcel
12 4121 Jul 30th 5:47 am
Zzdbl520
Trouble compiling NWChem with CUDA enabled
Started By : Jwkeller
11 2930 Jul 24th 1:44 am
Lbarnes
Is Nwchem 6.3 very demanding for I/O performance?
Started By : Xiongyan21
1 1248 Jul 22nd 3:11 pm
Mernst
Compling NWChem with OpenMPI static linkage on Ubuntu 8.10
Started By : Sdecherchi
2 2014 Jul 22nd 1:46 am
Sdecherchi
Cray XC30 and CLE 5.2
Started By : Dgrimwood
0 1057 Jul 20th 6:30 pm
Dgrimwood
Instructions in the manual cannot set modules and define target
Started By : Xiongyan21
10 1925 Jul 9th 5:47 am
Xiongyan21
Problem with Compilation on Intel Xeon 5670, GNU/Linux CentOS 5 x86_64
Started By : Yulia
1 1220 Jul 8th 10:59 am
Edoapra
NWCHEM 6.1.1 on MIC node
Started By : Hkikuchi
3 1239 Jul 2nd 1:40 pm
Hkikuchi
Making libraries in tools fails when compiling Nwchem6.3 revision2 on MAC
Started By : Xiongyan21
0 1292 Jun 26th 7:19 pm
Xiongyan21
GA failing to compile in NWChem6.1.1
Started By : WillEverett
0 1011 Jun 26th 12:24 pm
WillEverett
Cannot Define NWCHEM_TOP in the Chosen Directory
Started By : Xiongyan21
1 1260 Jun 25th 11:32 pm
Mernst
error compiling nwchem 6.3 last version released1 2
Started By : Lorenzodona
16 7493 Jun 25th 10:26 am
Obm

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