Compiling NWChem

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Compiling NWCHEM with Python 3.4
1 2224 Dec 23rd 11:07 am
Edoapra
Build_nwchem script for MELLANOX
0 1698 Dec 20th 7:47 am
Semmen
MA fatal error: MA_sizeof: invalid datatype: 343597384693
5 2837 Dec 13th 7:55 pm
Eenjoyzoo
NWchem 6.1 with CCSDTQ and CCSDTLR
2 3873 Dec 10th 9:42 am
Jhammond
having some problems with 6.1.1 and qlogic openmpi1 2
16 11827 Dec 10th 9:21 am
Jhammond
Linking NWChem against Intel's MKL
6 6351 Dec 10th 9:11 am
Jhammond
Compilation error in CRAY XE6 with nwchem version 6.3
3 1502 Nov 22nd 3:03 am
Jahir123
Depend.x file in compilation of software
0 1378 Nov 13th 11:21 pm
Ramadavidgroup
NWChem 6.5 and Intel Xeon Phis with intel 14.0.3 and intelmpi 4.1.3
7 2957 Nov 12th 4:29 am
Chrisn77
How to make quadratical ROHF converge in cr_eomccsd_t_xmem calculation?
1 1530 Nov 6th 7:33 pm
Xiongyan21
compile with ifort, openmpi, ib
2 2846 Oct 28th 8:19 am
Ysagon
f77 and mpif77 is conflict - Not properly synchronize with make file
7 2736 Oct 24th 3:27 pm
Edoapra
Are the patches already included in the source code or necessary to be installed?
2 1817 Oct 17th 7:36 pm
Xiongyan21
Global Array Toolkit Compilation Errors on Mac OS X 10.9.5
3 2108 Oct 16th 8:57 am
Xiongyan21
Cygwin not compiling - Nwchem-6.5.revision26243-src.2014-09-10
5 2722 Sep 25th 1:27 pm
Edoapra
compile nwchem-6.3 with mkl (blas e lapack) sequential
3 3785 Sep 24th 2:31 pm
Gabe
Error message in compiling nwchem with mpi
4 3612 Sep 24th 11:27 am
Edoapra
building NWChem with Intel 14.0 and OpenMPI 1.6.5
5 1802 Sep 23rd 3:04 pm
Edoapra
NWChem failing to run on IB nodes
3 1989 Sep 23rd 8:56 am
Edoapra
How to use ARMCI_NETWORK for NWChem 6.3 on SGI ICE X
13 4968 Sep 23rd 2:46 am
Jhammond
Nwchem 6.5 and build_nwchem script.
2 1761 Sep 22nd 7:24 am
Ivo
Mingw32 compilation - attempt two
7 4795 Sep 20th 7:42 am
P99
Issue with pspw using nwchem 6.3 on AMD Bulldozer -- bug in nwchem 6.3?
6 3490 Sep 16th 6:04 pm
Ohlincha
Having Issue Compiling Nwchem 6.3
9 2620 Sep 13th 6:58 am
Edoapra
Nwchem 6.3 checking whether a simple Fortran MPI program compiles... no
5 6738 Sep 13th 6:49 am
Edoapra
A bug in compiling nwchem 6.5
4 1632 Sep 11th 10:09 am
Hajiabadi

Forum >> NWChem's corner >> Compiling NWChem
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