Compiling NWChem

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Locked Sticky: NWChem 6.8 available for dowload
Started By : Edoapra
0 1090 Dec 14th 2:51 pm
Edoapra

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Cuda compiling1 2
Started By : KAZat
21 4461 Feb 18th 1:23 am
KAZat
Windows 7 64-bit install
Started By : Craigwb
3 2861 Feb 15th 1:18 pm
Edoapra
Error: Function `GA_MPI_Comm_pgroup_default' implicitly converted to pointer at util_getppn.c:45
Started By : Mbanck
2 1530 Feb 15th 11:47 am
Edoapra
ld: cannot find -lpython2.7
Started By : Gwolosh
13 2559 Feb 3rd 5:40 am
Gwolosh
NWChem 6.6 and OS X El Capitan1 2
Started By : 58607
16 6103 Jan 25th 10:42 am
58607
Similar compilation problems NWChem-6.6
Started By : Proteindj
13 2639 Jan 22nd 8:36 am
Proteindj
int/Integer argument type mismatch inside peigs is causing segmentation fault
Started By : Bvoigt
6 1221 Jan 21st 11:11 am
Bvoigt
configure: error: f2c string convention is neither after args nor after string
Started By : Ylniu
1 903 Jan 21st 10:29 am
Edoapra
Compilation problem with NWChem.
Started By : Abhay ms
0 736 Jan 19th 8:39 am
Abhay ms
nwchem-6.6 ifort, segmentation fault1 2
Started By : Sbbfifa
16 6876 Jan 13th 2:19 pm
Sbbfifa
NWchem-6.5 compilation: Segmentation fault
Started By : Anastasia.phys
4 1616 Jan 13th 3:17 am
Anastasia.phys
undefined symbols for architecture x86/64
Started By : LJ
2 1103 Dec 31st 12:26 pm
LJ
NWChem 6.6/CentOS 7 compile fails
Started By : Jwkeller
14 3620 Dec 21st 9:50 pm
Frankenstein
Compiling NWChem 6.6 on openSUSE42.11 2
Started By : Frankenstein
16 4389 Dec 18th 1:12 pm
Frankenstein
compilation problem with nwchem-rev26871.2015-02-24
Started By : Jtravers
5 2051 Dec 9th 10:29 am
Edoapra
Compiling NWCHEM in a local university cluster
Started By : Rahulsng
3 1379 Dec 6th 7:32 am
YALDA88
Ga library for compiling nwchem 6.6
Started By : Nsapiens
2 922 Dec 2nd 3:46 am
Nsapiens
Linking problem with NWChem 6.6, Intel compilers and Infiniband
Started By : Valtandor
3 1454 Dec 1st 11:58 am
Valtandor
Problems in compiling NWChem
Started By : Alessandro.chiesa
14 1754 Nov 29th 8:25 am
Alessandro.chiesa
too many arguments error
Started By : LJ
8 3296 Nov 23rd 1:03 pm
Edoapra
Memory-related failures in QA
Started By : Cchang
1 1013 Nov 12th 5:29 pm
Edoapra
NWchem6.6 on OpenSUSE compile fails: ld: cannot find -lga -larmci
Started By : Hhaoissp
2 1972 Nov 9th 7:18 pm
Hhaoissp
Patch to allow internal coordinates for icosahedral clusters
Started By : Hloupy.Honza
3 1681 Nov 5th 5:01 pm
Edoapra
NWChem 6.6 and 6.5 Can Be Compiled on MAC OS X EI Capitan 10.11
Started By : Xiongyan21
1 1064 Oct 29th 11:13 pm
Xiongyan21
Add additional libraries in linking
Started By : Jtravers
7 1895 Oct 10th 11:07 am
Jtravers

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