Compiling NWChem

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Locked Sticky: NWChem 6.8 available for dowload
Started By : Edoapra
0 170 Dec 14th 1:51 pm
Edoapra

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Compiling NWChem 6.1 on Ubuntu 12.04 with OpenMPI 1.6
Started By : DouDou
2 3392 Aug 1st 8:06 pm
DouDou
compiling nwchem with mpich2
Started By : Qjklw2012
3 2974 Jul 31st 8:55 am
Edoapra
Problems compiling nwchem with openSUSE, gcc, mpich
Started By : Qjklw2012
3 2358 Jul 30th 4:53 pm
Qjklw2012
simple installation fail
Started By : Schezel2000
2 3679 Jul 25th 3:03 pm
Schezel2000
NWChem 6.1.1 RedHat 5.4, Intel 11.1, OpenMPI 1.3.4
Started By : Colinbann
4 2527 Jul 20th 5:43 am
Colinbann
Must NWchem 6.1 be compiled from source for multi-proc parallel execution?
Started By : Jwkeller
1 1684 Jul 5th 9:06 am
Bert
Compiling NWChem With MKL
Started By : Aguilar853
1 1374 Jun 25th 10:55 am
Aguilar853
problem on armci-network protocol
Started By : Yjleedaniel
5 3337 Jun 15th 8:30 am
Bert
Compiling questions
Started By : Lmyiop
3 3459 May 30th 1:42 pm
Bert
Compiling with MPI under cygwin
Started By : Ivo
11 9491 May 16th 4:15 pm
Bert
CentOS 5.7, RHEL5.2 NWChem 6.1 64 bit will build ok, but crash when run causing seg violation
Started By : Fiu chemistry
4 3259 May 7th 7:59 am
Fiu chemistry
cygwin compilation issues
Started By : JimW
3 3117 Apr 12th 9:54 am
SergeL
Compiling with MVAPICH2 leads to undefined references
Started By : Deburgess
2 3532 Apr 9th 4:26 pm
Deburgess
Compiling with OpenFabrics interface
Started By : Deburgess
1 2112 Apr 9th 12:35 pm
Bert
(Help!) Compiling NWChem6.1 with ifort,icc,mpich2, and mkl library
Started By : Yjleedaniel
6 4049 Mar 30th 2:23 pm
Bert
Compiling NWChem as a library
Started By : Logsdail
2 1638 Mar 16th 5:35 am
Logsdail
Building NWChem 6.1 with openmpi
Started By : Ian gay
2 2428 Feb 29th 5:33 pm
Bert
NWChem 6.1 linking problem
Started By : Marcindulak
7 5972 Feb 18th 3:59 am
Marcindulak
NWChem 6.1 scalapack compilation fails
Started By : Guest -
14 7359 Feb 17th 9:23 am
Edoapra
contrib/mov2asc contains binaries
Started By : Marcindulak
1 2087 Feb 10th 10:17 am
Bert
contrib/python/Gnuplot.py incompatible with new pythons
Started By : Marcindulak
2 3549 Feb 9th 11:42 pm
Marcindulak
Linux workstation, MPI and QA tests
Started By : Ckoe
4 5008 Feb 9th 2:38 am
Ckoe
10 QA tests failed using downloaded binaries
Started By : Mwykes
3 1977 Feb 3rd 9:40 am
Niri
NWCHEM_Modules for plane wave only?
Started By : Guest -
1 1658 Jan 31st 12:34 pm
Bert
Compiling with GotoBLAS2
Started By : Guest -
7 4604 Jan 30th 2:04 pm
Guest -

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