Compiling NWChem

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Announcement's	Replies	Views	Last Action
Sticky: Beta version of NWChem 6.6 available for download Started By : Edoapra	2	250	Sep 30th 10:14 am Edoapra
NWChem 6.5 has been released Started By : Karol	0	9010	Sep 15th 11:02 am Karol

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Thread Title	Replies	Views	Last Action
Nwchem(any version) and NBO (5.9) linking Started By : Roon	7	2734	Feb 25th 11:33 am Bert
NBO 6.0 Started By : Jwkeller	1	1501	Feb 19th 1:12 pm Jwkeller
Torque Started By : Wjb0920	5	1388	Feb 9th 7:12 pm Wjb0920
Linking Problems Started By : CoolEsza	5	1735	Feb 8th 11:23 am Edoapra
Compiling on IBM P775 Started By : Lukas Demovic	2	1359	Feb 6th 1:11 am Lukas Demovic
ggg Started By : Wjb0920	5	1342	Feb 4th 8:40 pm Wjb0920
Compiling with i4 instead of i8 on 64-bit machine Started By : Logsdail	8	1709	Jan 18th 5:16 pm Logsdail
MPI-parallel plane wave build Started By : Gabe	6	1917	Jan 10th 1:34 pm Bert
parllel NWChem 6.1.1 vs Ubuntu 12.04 Started By : Clef	1	1711	Nov 28th 10:51 am Huub
Compiling NWChem 6.1 on Ubuntu 12.04 Started By : Flaregunhobo	2	1602	Nov 27th 10:51 pm Flaregunhobo
Compiling NWCHEM on Centos6.1 openmpi1.6 ifort icc Started By : Sacch	12	2885	Nov 23rd 2:48 am Sacch
undefined references in 6.1.1 Started By : Goranka	3	1708	Nov 22nd 3:17 am Sacch
compiling 6.1.1 Started By : Zhdsheng	4	3069	Nov 20th 9:27 am WillEverett
undefined reference to '_gfortran_copy_string' Started By : Rwohlhueter	12	5055	Nov 16th 10:24 am Edoapra
Compiling NWChem 6.1 on Rocks Cluster 6.0 Started By : Flo-lim	6	2200	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 Started By : Dauria	5	4943	Oct 28th 10:35 pm Andypea
segmentation fault--running small test case, compiled with gfortran Started By : Dkanan	12	6137	Oct 15th 1:11 pm Edoapra
Infiniband Install Started By : Mef362	8	3616	Oct 5th 9:28 am Mef362
CCSD(T) on SGI UV1000 Started By : Iwatasuehiro	1	1579	Oct 2nd 11:50 am Edoapra
RPMS of Nwchem Started By : Marcindulak	2	1547	Sep 28th 1:04 pm Bert
compiling v6.1 for tcgmsg Started By : Rwohlhueter	1	1116	Sep 10th 9:16 am Edoapra
6.1.1 MPI build runs great, but only on 1 node1 2 Started By : Chemogan	24	14378	Aug 29th 9:34 am Edoapra
Problelms compiling 6.1.1 on Cray XE6 Started By : Pdc	2	1747	Aug 22nd 3:48 am Pdc
Problems compiling nwchem with openSUSE, gcc, openmpi Started By : Jwkeller	12	5056	Aug 9th 2:34 pm Bert
Compiling NWChem 6.1 on Ubuntu 12.04 with OpenMPI 1.6 Started By : DouDou	2	2204	Aug 1st 9:06 pm DouDou

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