Compiling NWChem

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups	0	1715	Jun 18th 5:01 pm Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload	0	13620	Dec 14th 2:51 pm Edoapra

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Thread Title	Replies	Views	Last Action
compiling 6.1.1	4	5591	Nov 20th 9:27 am WillEverett
undefined reference to '_gfortran_copy_string'	12	10692	Nov 16th 10:24 am Edoapra
Compiling NWChem 6.1 on Rocks Cluster 6.0	6	3740	Nov 5th 10:59 am Flo-lim
Building NWChem 6.1 with Intel 11.1 and Openmpi 1.6 on a IB cluster running CentOS 6.2	5	7668	Oct 28th 10:35 pm Andypea
segmentation fault--running small test case, compiled with gfortran	12	10936	Oct 15th 1:11 pm Edoapra
Infiniband Install	8	7652	Oct 5th 9:28 am Mef362
CCSD(T) on SGI UV1000	1	2951	Oct 2nd 11:50 am Edoapra
RPMS of Nwchem	2	2838	Sep 28th 1:04 pm Bert
compiling v6.1 for tcgmsg	1	1943	Sep 10th 9:16 am Edoapra
6.1.1 MPI build runs great, but only on 1 node1 2	24	28146	Aug 29th 9:34 am Edoapra
Problelms compiling 6.1.1 on Cray XE6	2	2605	Aug 22nd 3:48 am Pdc
Problems compiling nwchem with openSUSE, gcc, openmpi	12	10014	Aug 9th 2:34 pm Bert
Compiling NWChem 6.1 on Ubuntu 12.04 with OpenMPI 1.6	2	4268	Aug 1st 9:06 pm DouDou
compiling nwchem with mpich2	3	3590	Jul 31st 9:55 am Edoapra
Problems compiling nwchem with openSUSE, gcc, mpich	3	3084	Jul 30th 5:53 pm Qjklw2012
NWChem 6.1.1 RedHat 5.4, Intel 11.1, OpenMPI 1.3.4	4	3884	Jul 20th 6:43 am Colinbann
Must NWchem 6.1 be compiled from source for multi-proc parallel execution?	1	2273	Jul 5th 10:06 am Bert
Compiling NWChem With MKL	1	1771	Jun 25th 11:55 am Aguilar853
problem on armci-network protocol	5	4034	Jun 15th 9:30 am Bert
Compiling questions	3	4292	May 30th 2:42 pm Bert
Compiling with MPI under cygwin	11	13318	May 16th 5:15 pm Bert
CentOS 5.7, RHEL5.2 NWChem 6.1 64 bit will build ok, but crash when run causing seg violation	4	4005	May 7th 8:59 am Fiu chemistry
cygwin compilation issues	3	3743	Apr 12th 10:54 am SergeL
Compiling with MVAPICH2 leads to undefined references	2	4881	Apr 9th 5:26 pm Deburgess
Compiling with OpenFabrics interface	1	2573	Apr 9th 1:35 pm Bert

Forum >> NWChem's corner >> Compiling NWChem

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