Compiling NWChem

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Announcement's Replies Views Last Action
Third release candidate for NWChem 6.8 available
Started By : Edoapra
7 349 Dec 3rd 3:06 pm
Edoapra
Bug in Raman code
Started By : Sean
0 2051 Feb 2nd 5:45 pm
Sean
NWChem 6.6: bug in geometry optimization
Started By : Edoapra
5 2177 Jan 28th 1:50 pm
Edoapra
Sticky: NWChem 6.6 available for download
Started By : Edoapra
0 5665 Oct 20th 3:12 pm
Edoapra

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Thread Title Replies Views Last Action
Cuda compiling1 2
Started By : KAZat
21 2944 Feb 18th 12:23 am
KAZat
Windows 7 64-bit install
Started By : Craigwb
3 1880 Feb 15th 12:18 pm
Edoapra
Error: Function `GA_MPI_Comm_pgroup_default' implicitly converted to pointer at util_getppn.c:45
Started By : Mbanck
2 1194 Feb 15th 10:47 am
Edoapra
ld: cannot find -lpython2.7
Started By : Gwolosh
13 1741 Feb 3rd 4:40 am
Gwolosh
NWChem 6.6 and OS X El Capitan1 2
Started By : 58607
16 4698 Jan 25th 9:42 am
58607
Similar compilation problems NWChem-6.6
Started By : Proteindj
13 1993 Jan 22nd 7:36 am
Proteindj
int/Integer argument type mismatch inside peigs is causing segmentation fault
Started By : Bvoigt
6 860 Jan 21st 10:11 am
Bvoigt
configure: error: f2c string convention is neither after args nor after string
Started By : Ylniu
1 660 Jan 21st 9:29 am
Edoapra
Compilation problem with NWChem.
Started By : Abhay ms
0 574 Jan 19th 7:39 am
Abhay ms
nwchem-6.6 ifort, segmentation fault1 2
Started By : Sbbfifa
16 5164 Jan 13th 1:19 pm
Sbbfifa
NWchem-6.5 compilation: Segmentation fault
Started By : Anastasia.phys
4 1184 Jan 13th 2:17 am
Anastasia.phys
undefined symbols for architecture x86/64
Started By : LJ
2 821 Dec 31st 11:26 am
LJ
NWChem 6.6/CentOS 7 compile fails
Started By : Jwkeller
14 2978 Dec 21st 8:50 pm
Frankenstein
Compiling NWChem 6.6 on openSUSE42.11 2
Started By : Frankenstein
16 2981 Dec 18th 12:12 pm
Frankenstein
compilation problem with nwchem-rev26871.2015-02-24
Started By : Jtravers
5 1793 Dec 9th 9:29 am
Edoapra
Compiling NWCHEM in a local university cluster
Started By : Rahulsng
3 1099 Dec 6th 6:32 am
YALDA88
Ga library for compiling nwchem 6.6
Started By : Nsapiens
2 762 Dec 2nd 2:46 am
Nsapiens
Linking problem with NWChem 6.6, Intel compilers and Infiniband
Started By : Valtandor
3 1139 Dec 1st 10:58 am
Valtandor
Problems in compiling NWChem
Started By : Alessandro.chiesa
14 1456 Nov 29th 7:25 am
Alessandro.chiesa
too many arguments error
Started By : LJ
8 2725 Nov 23rd 12:03 pm
Edoapra
Memory-related failures in QA
Started By : Cchang
1 751 Nov 12th 4:29 pm
Edoapra
NWchem6.6 on OpenSUSE compile fails: ld: cannot find -lga -larmci
Started By : Hhaoissp
2 1576 Nov 9th 6:18 pm
Hhaoissp
Patch to allow internal coordinates for icosahedral clusters
Started By : Hloupy.Honza
3 1569 Nov 5th 4:01 pm
Edoapra
NWChem 6.6 and 6.5 Can Be Compiled on MAC OS X EI Capitan 10.11
Started By : Xiongyan21
1 840 Oct 29th 10:13 pm
Xiongyan21
Add additional libraries in linking
Started By : Jtravers
7 1412 Oct 10th 10:07 am
Jtravers

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