Compiling NWChem
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bse.pnl.gov replaced by www.basissetexchange.org. BSE forum closed
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Jun 7th 4:53 pm
Edoapra
Locked Sticky:
NWChem 7.0.0 available for dowload
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Dec 14th 2:51 pm
Edoapra
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contrib/mov2asc contains binaries
1
2535
Feb 10th 11:17 am
Bert
contrib/python/Gnuplot.py incompatible with new pythons
2
4088
Feb 10th 12:42 am
Marcindulak
Linux workstation, MPI and QA tests
4
5822
Feb 9th 3:38 am
Ckoe
10 QA tests failed using downloaded binaries
3
2537
Feb 3rd 10:40 am
Niri
NWCHEM_Modules for plane wave only?
1
2131
Jan 31st 1:34 pm
Bert
Compiling with GotoBLAS2
7
5407
Jan 30th 3:04 pm
Guest -
code compilation
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1929
Jan 25th 11:28 am
Bert
win32
5
8060
Dec 29th 9:15 am
Guest -
Compiling for MPI.
6
5864
Dec 28th 4:58 pm
Davis68
RPMS of NWchem
4
5459
Dec 21st 4:37 am
Marcindulak
MPI references not found
2
2171
Dec 2nd 5:13 pm
Bert
The Oct 2010 patch to nwchem-6.0 changes intermediate results after forming the initial gue
3
2468
Dec 1st 12:44 am
Guest -
Compiling Problems
4
2255
Nov 24th 10:05 am
Marcindulak
Help with non-standard MPI compiler
5
3620
Oct 27th 8:14 am
Guest -
NwChem for Cygwin - legacy question
2
2570
Oct 1st 3:02 am
Guest -
NWChem install on Cray XD1?
0
2302
Sep 26th 2:40 pm
Guest -
checksum for release tarballs?
3
2420
Sep 22nd 6:54 pm
Guest -
NWChem 6.0 with Intel Compilers
7
5422
Aug 19th 12:46 am
Shenggangli
Compiling NWChem Advice....
13
4777
Aug 11th 1:26 am
Guest -
Changing to a build system
1
2597
Aug 2nd 5:13 pm
Bert
How to build on SGI Altix ICE
4
5042
Aug 2nd 5:10 pm
Bert
There is no nwchem_config file
3
3186
Aug 2nd 5:05 pm
Bert
Seeking advice on building 6.0 on Cray XE (CLE 3.1)
1
2302
Jun 1st 5:06 pm
Bert
Compilation on IBM Power7 and AIX 6.1
4
5858
May 5th 9:37 am
Guest -
ARMCI problem on SGI Altix
8
3452
May 3rd 12:06 am
Luke
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