Compiling NWChem

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Announcement's Replies Views Last Action
Bug in Raman code
Started By : Sean
0 1837 Feb 2nd 6:45 pm
Sean
NWChem 6.6: bug in geometry optimization
Started By : Edoapra
0 1904 Jan 28th 2:50 pm
Edoapra
Sticky: NWChem 6.6 available for download
Started By : Edoapra
0 5365 Oct 20th 4:12 pm
Edoapra

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Thread Title Replies Views Last Action
Failure to compile NWChem with MPICH on CentOS
Started By : Rangsiman
11 97 Sep 11th 10:31 pm
Rangsiman
QA kinda failing
Started By : Cchang
5 45 Sep 8th 11:30 am
Edoapra
How to uninstall NWChem from Mac?
Started By : Yipy0010
1 29 Sep 5th 3:44 pm
Edoapra
Error with pre-processing nwchem.F
Started By : Cchang
1 19 Sep 5th 10:11 am
Cchang
A request for help1 2
Started By : Jason York
18 880 Aug 20th 5:53 am
Dathan87
Post Deleted
Started By : Chiensh
0 40 Aug 17th 7:31 pm
Chiensh
Compilation Problems with Centos 7.3
Started By : Jgamez
2 226 Aug 13th 5:04 am
Marcindulak
win32
Started By : P99
15 117 Aug 4th 12:11 pm
P99
Using Tau Profiler with Intel fortran
Started By : Mmadrid
2 59 Jul 31st 2:09 pm
Mmadrid
Compilation on Mac OS X
Started By : Driesvr
8 424 Jul 26th 4:30 am
Mgreuter
undefined reference to `blacs_gridinfo
Started By : Adrianam
0 90 Jul 14th 10:31 am
Adrianam
Compile NWChem with Intel 2017 (MPI + MKL)
Started By : Cyberwolf
4 262 Jun 23rd 11:45 am
Cyberwolf
Problem with downloading patch HFmke.patch.gz
Started By : Swsides
1 134 May 22nd 2:25 pm
Edoapra
Building NWChem 6.6 without MPI
Started By : Swsides
0 161 May 11th 1:05 pm
Swsides
Undefined references for nwchem6.6 on ubuntu 16.04
Started By : Jhelfferich
2 271 Apr 25th 10:07 pm
Jhelfferich
NWChem 6.6 gfortran+MKL
Started By : Dishu1
0 191 Apr 15th 3:33 am
Dishu1
Compilation with OpenMPI
Started By : Chiensh
9 283 Apr 7th 11:10 am
Edoapra
nwchem not running in IBM ppc64 le
Started By : Tamalgoswami
0 152 Apr 3rd 6:41 am
Tamalgoswami
Improper compilation causes memory error during running nwchem
Started By : DanChQ
13 598 Mar 1st 3:02 am
DanChQ
Problem in running NWChem.
Started By : Bikash Patra
3 306 Feb 27th 11:03 am
Bikash Patra
MPI errors Centos 7.3
Started By : Deej
4 394 Feb 8th 12:25 pm
Deej
NWChem is successfully built on mac OS Sierra10.12.3 with GCC6.3.0 and mpich3.2_2.
Started By : Xiongyan21
0 395 Feb 2nd 4:06 am
Xiongyan21
How to recompile nwchem 6.6.
Started By : Bikash Patra
0 314 Jan 25th 1:04 am
Bikash Patra
compiling on centos~~ can't find Python.h
Started By : Zww9
10 701 Jan 18th 12:36 pm
Zww9
Failure to compile on MinGW with MSYS
Started By : Covalent
3 1326 Jan 17th 10:59 am
Edoapra

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