Compiling NWChem

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups
0 1715 Jun 18th 5:01 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
0 13620 Dec 14th 2:51 pm
Edoapra

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Ubuntu Root Password Blocks Running NWChem6.8
1 1044 Jan 14th 2:00 am
Xiongyan21
Compiling Ubuntu 17.10
2 897 Jan 13th 5:48 pm
Diego paschoal
An attempt to run as root problem encounted by NWCHEM on Ubuntu17.10
1 1642 Jan 11th 6:34 am
Xiongyan21
NWCHEM6.8 Has Been Successfully Built on macOS High Sierra with MPICH2 3.2.1
0 975 Jan 8th 8:33 pm
Xiongyan21
Compilation of NWCHEM6.8 Failed on macOS High Sierra with Openmpi 3.0.0_1
0 1072 Jan 7th 8:06 pm
Xiongyan21
NWChem 6.6: MA fatal error: MA_sizeof: invalid datatype (macOS)
13 2749 Dec 27th 10:02 pm
Jhammond
Second Official Candidate Release of NWCHEM6.8 cannot be compiled on Ubuntu17.10
8 2735 Dec 6th 6:15 am
Xiongyan21
Official Candidate Release of NWCHEM6.8 cannot be compiled on MAC
12 1999 Nov 21st 9:47 pm
Xiongyan21
Compile only TCE part in NWChem
1 973 Nov 3rd 12:11 pm
Edoapra
cosmoP.fh: No such file or directory
1 905 Oct 26th 9:43 am
Edoapra
windows 10 64
4 1944 Oct 16th 7:34 am
P99
Failed to compile NWChem 6.6 with MVAPICH2 on CentOS
11 2105 Sep 11th 10:31 pm
Rangsiman
QA kinda failing
5 1090 Sep 8th 11:30 am
Edoapra
How to uninstall NWChem from Mac?
1 1076 Sep 5th 3:44 pm
Edoapra
Error with pre-processing nwchem.F
1 940 Sep 5th 10:11 am
Cchang
Post Deleted
0 916 Aug 17th 7:31 pm
Chiensh
Compilation Problems with Centos 7.3
2 1385 Aug 13th 5:04 am
Marcindulak
win32
15 1634 Aug 4th 12:11 pm
P99
Using Tau Profiler with Intel fortran
2 1085 Jul 31st 2:09 pm
Mmadrid
Compilation on Mac OS X
8 2909 Jul 26th 4:30 am
Mgreuter
undefined reference to `blacs_gridinfo
0 1707 Jul 14th 10:31 am
Adrianam
Compile NWChem with Intel 2017 (MPI + MKL)
4 4795 Jun 23rd 11:45 am
Cyberwolf
Problem with downloading patch HFmke.patch.gz
1 1090 May 22nd 2:25 pm
Edoapra
Building NWChem 6.6 without MPI
0 1023 May 11th 1:05 pm
Swsides
Undefined references for nwchem6.6 on ubuntu 16.04
2 1514 Apr 25th 10:07 pm
Jhelfferich
NWChem 6.6 gfortran+MKL
0 1112 Apr 15th 3:33 am
Dishu1

Forum >> NWChem's corner >> Compiling NWChem
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