Compiling NWChem

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Thread Title	Replies	Views	Last Action
Nwchem-src-2014-01-28: ARMCI_NETWORK=SOCKETS no longer supported?	2	4318	Feb 15th 5:27 am Msxtj
scratch directory not accessible	6	4179	Feb 11th 5:39 pm Kmh603
Windows Compiling Error	1	2118	Feb 1st 9:29 am Rrenslow
Patch apply	0	2117	Feb 1st 2:02 am Masrul
Intel Xeon Phi compilation error	6	4063	Jan 29th 11:52 pm Masrul
NWChem compilation in mixed cluster	1	1867	Jan 24th 8:44 am Jhammond
Building NWChem on cray failed	5	2576	Jan 15th 2:48 pm Edoapra
QA tests and verification for nwchem 6.5 and hess/vib modules1 2	16	11294	Jan 2nd 3:44 pm Edoapra
Compile Nwchem 6.5 with Intel MPI	2	2903	Dec 31st 5:43 pm Extremis
HWLoc on multi-core Opteron defect - how to tell NWChem to choose other MPI packages	1	2195	Dec 23rd 11:16 am Edoapra
Compiling with MPICH	2	2349	Dec 23rd 11:14 am Edoapra
Compiling NWCHEM with Python 3.4	1	2224	Dec 23rd 11:07 am Edoapra
Build_nwchem script for MELLANOX	0	1698	Dec 20th 7:47 am Semmen
MA fatal error: MA_sizeof: invalid datatype: 343597384693	5	2837	Dec 13th 7:55 pm Eenjoyzoo
NWchem 6.1 with CCSDTQ and CCSDTLR	2	3873	Dec 10th 9:42 am Jhammond
having some problems with 6.1.1 and qlogic openmpi1 2	16	11828	Dec 10th 9:21 am Jhammond
Linking NWChem against Intel's MKL	6	6351	Dec 10th 9:11 am Jhammond
Compilation error in CRAY XE6 with nwchem version 6.3	3	1502	Nov 22nd 3:03 am Jahir123
Depend.x file in compilation of software	0	1378	Nov 13th 11:21 pm Ramadavidgroup
NWChem 6.5 and Intel Xeon Phis with intel 14.0.3 and intelmpi 4.1.3	7	2957	Nov 12th 4:29 am Chrisn77
How to make quadratical ROHF converge in cr_eomccsd_t_xmem calculation?	1	1530	Nov 6th 7:33 pm Xiongyan21
compile with ifort, openmpi, ib	2	2846	Oct 28th 8:19 am Ysagon
f77 and mpif77 is conflict - Not properly synchronize with make file	7	2736	Oct 24th 3:27 pm Edoapra
Are the patches already included in the source code or necessary to be installed?	2	1817	Oct 17th 7:36 pm Xiongyan21
Global Array Toolkit Compilation Errors on Mac OS X 10.9.5	3	2108	Oct 16th 8:57 am Xiongyan21

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