Compiling NWChem


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bse.pnl.gov replaced by www.basissetexchange.org. BSE forum closed
0 9996 Jun 7th 4:53 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
0 12333 Dec 14th 2:51 pm
Edoapra

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Problem building NWChem version 6.5 on IB cluster with MKL & IntelMPI1 2
24 11698 Sep 11th 3:41 pm
Edoapra
Compiling problems with Fedora 19
3 1392 Sep 11th 11:34 am
Edoapra
Difficulty Compiling NWChem on Cray - Numerous Undefined References
4 3010 Sep 2nd 1:07 am
Chrisbutch
Compiling mov2asc fails
7 3716 Aug 29th 9:14 pm
Vladimir
Function 'ydot' at (1) has no IMPLICIT type
3 3005 Aug 28th 6:53 am
Marcindulak
MA fatal error: MA_sizeof: invalid datatype:
1 1520 Aug 24th 10:18 am
Edoapra
Problems compiling
2 1981 Aug 17th 6:26 pm
Evanccoleman
BLAS, LAPACK not found while compiling NWchem 6.5 against Intel MKL on a LINUX cluster
12 6237 Jul 27th 4:59 am
Alexdiazortiz
Compiling issue.1 2
19 10577 Jul 23rd 11:50 am
Edoapra
Mingw32 compilation1 2
30 14378 Jul 18th 10:39 am
Avelon
armci undefined symbols building 6.5 on OS X 10.10.2
3 2055 Jul 15th 5:55 pm
Mernst
MA error in mov2asc with NWchem6.5
2 1641 Jul 2nd 12:54 pm
Edoapra
Having problems with compiling NWCHEM6.5 on Mac OS X Yosemite 10.10.3
3 2028 Jun 14th 10:05 am
Pguo1
Error compiling nwchem-6.5 in Ubuntu
3 1723 Jun 4th 2:50 pm
Edoapra
error with revision 27151
1 1264 Jun 1st 10:57 pm
Edoapra
Problems with NWChem compilation on Linux
11 6291 May 27th 7:12 am
Anastasia.phys
mov2asc
2 2098 May 19th 3:26 am
P99
Is the following combination of env. variables required on MAC OS 10.10.3 When compiled with Python?
2 1733 May 10th 12:53 am
Xiongyan21
BLUEGENE compilation for big number of atoms
0 1277 May 4th 2:42 am
CoolEsza
When compiled with Python is the following combination of env. variables required on MAC OS 10.10.3?
0 1190 May 2nd 7:42 am
Xiongyan21
multiple definition of `util_mic_set_affinity_' at util_mic_support.c:176
1 2818 May 1st 6:10 pm
Edoapra
error with opmpi1.65 and gfortran
1 1650 Apr 27th 11:41 am
Edoapra
compile NWCHEM 6.5 ubuntu 14.04 error
1 1757 Apr 20th 10:53 am
Edoapra
error with impi on centos7
7 2286 Apr 16th 10:49 am
Edoapra
Segmentation fault with Scalapack from MKL
5 1510 Apr 16th 12:57 am
Attacc

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