Compiling NWChem

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Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
0 13620 Dec 14th 2:51 pm
Edoapra

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Cray XT5: cannot run (../../ga-5-2/armci/src-portals/locks.h: 16)
4 2033 Oct 25th 8:50 am
Astreib
Compilation error with include/mafdecls.fh
2 3886 Oct 24th 9:40 am
Huub
MemRegister error
7 112763 Oct 3rd 3:02 am
Chrisa
Compilation problem using Intel 2013 compiler
8 4126 Sep 23rd 8:53 am
Edoapra
SOLVED How to include CCSDT-LR in NWchem
0 1600 Sep 14th 5:15 pm
Lyzhao
Compile on BGQ
1 1757 Aug 29th 10:10 am
Edoapra
nwchem-6.3 compiling error with gcc 4.8.0 and mvapich2-1.9
2 2209 Aug 20th 5:36 pm
Jtravers
unable to link LAPACK from intel mkl
2 5058 Aug 15th 8:37 pm
Karteek
ipo: warning #11010: file format not recognized for /opt/intel/bin
2 4498 Aug 12th 11:26 am
Jbaltrus
NWChem 6.3 with OpenMPI: configure error: f2c string convention
4 4390 Jul 22nd 8:57 am
Jagode
problem installing NWChem6.1.1 w/Python
1 2070 Jul 17th 6:21 pm
Edoapra
patches for nwchem-6.3
1 2281 Jul 16th 1:11 pm
Edoapra
Problem with installing nwchem6.3 in fedora 14 : package couldn't found.
1 2238 Jul 10th 9:24 am
Bert
6.3 openib build problems?
4 3695 Jul 9th 8:59 am
Edoapra
6.3 openmpi/openib/intel build script?
3 1955 Jul 9th 8:34 am
Huub
NWChem MD efficiency
0 2749 Jun 27th 7:33 pm
Sacch
compiling without MPI
2 3750 Jun 27th 2:20 pm
MHermes
NWChem-6.3 (2013-05-28) on SUSE Linux
5 4201 Jun 21st 9:19 pm
Tz
MA fatal error: MA_sizeof: invalid datatype
2 4226 Jun 19th 7:37 pm
Davis68
Gaussian orbital dft in Nwchem 6.3
2 1823 Jun 19th 5:30 pm
Bert
Can NWChem be compiled usingc99?
2 1888 Jun 13th 9:45 am
WillEverett
forrtl: severe (174): SIGSEGV, segmentation fault occurred
2 5815 Jun 2nd 1:37 pm
Alfcanova
Problem with NWChem 6.3 and Qlogic
2 1802 May 29th 2:14 am
Chemistza
Solved: Nwchem 6.3 running 2-5 times slower than 6.1.1
11 20708 May 22nd 8:34 pm
Ohlincha
Linking Problems when compiling NWChem 6.3
9 3148 May 22nd 5:41 pm
DouDou

Forum >> NWChem's corner >> Compiling NWChem
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