Compiling NWChem


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bse.pnl.gov replaced by www.basissetexchange.org. BSE forum closed
 0 9996 Jun 7th 4:53 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
 0 12333 Dec 14th 2:51 pm
Edoapra

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NWChem 6.6 compiles but doesn't work on the new Fedora 24
 2 3164 Jul 19th 7:54 am
LonelySpooky
NWChem 6.6 Mac LinAlg error
 9 1594 Jul 13th 1:09 pm
Checksum
compiling on ubuntu with python
 3 1122 Jun 21st 5:27 am
RamanRamanRaman
Compiling issue
 2 1095 Jun 16th 1:25 am
Jtandy
Compiling on IBM Power7
 0 1000 Jun 10th 3:58 am
Lukas Demovic
Compiling NWChem with Intel 2016
 6 3283 May 24th 6:19 am
Twk
compiling nwchem-6.6 with infiniband
 3 1492 May 17th 11:54 am
Heisen
compiling NWChem 6.6 on Centos6
 2 1634 May 16th 7:04 pm
Douraku
Compiling NWChem 6.6 (ubuntu 14.04)
 8 3671 May 12th 8:52 pm
Vladimir
Compiling NWChem 6.6 Error INTEL 16.1 MKL and openmpi
 1 1226 May 4th 9:11 am
Jemmyhu
Bug in Raman code: How to patch?
 1 1415 Apr 25th 11:48 am
Edoapra
Optimizing parallel performance on Xeon(R)
 0 1727 Apr 5th 6:37 pm
Maxjr
compiling conflict
 2 2394 Mar 30th 5:48 am
Rasmus
MAC OS EI Capitan 10.11.4 with Xcode 7.3 Supports NWChem6.6
 0 1354 Mar 29th 3:25 am
Xiongyan21
Compiling nwchem-6.6 with mkl and openmpi
 1 2600 Mar 17th 2:09 am
Robin1991
nwchem-6.6/src/config/nwchem_config.h: No such file or directory
 0 2462 Mar 7th 12:32 pm
Andrew.downs
NWChem 6.6 compiling Library error
 0 1431 Feb 29th 7:14 am
Misha
Compiling VENUS/NWChem6.6 "undefined reference to"
 0 1749 Feb 19th 2:48 pm
Misha
Cuda compiling1 2
 21 8330 Feb 18th 1:23 am
KAZat
Windows 7 64-bit install
 3 5296 Feb 15th 1:18 pm
Edoapra
Error: Function `GA_MPI_Comm_pgroup_default' implicitly converted to pointer at util_getppn.c:45
 2 2538 Feb 15th 11:47 am
Edoapra
ld: cannot find -lpython2.7
 13 4961 Feb 3rd 5:40 am
Gwolosh
NWChem 6.6 and OS X El Capitan1 2
 16 9224 Jan 25th 10:42 am
58607
Similar compilation problems NWChem-6.6
 13 3739 Jan 22nd 8:36 am
Proteindj
int/Integer argument type mismatch inside peigs is causing segmentation fault
 6 1884 Jan 21st 11:11 am
Bvoigt

Forum >> NWChem's corner >> Compiling NWChem
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