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Announcement's	Replies	Views	Last Action
NWChem 6.5 has been released Started By : Karol	0	5269	Sep 15th 11:02 am Karol
Locked Sticky: Anonymous posting on the NWChem forum has been disabled. Please create an account before posting. Started By : Bert	0	7669	Feb 2nd 7:13 pm Bert

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Thread Title	Replies	Views	Last Action
New user needing help with NWChem Started By : LonelySpooky	4	503	Sep 7th 1:07 am LonelySpooky
EA/IP-EOM-CC Implemented in nwchem? Started By : Cmjohns6	4	621	Sep 5th 10:19 am Karol
unable to locate singlet diradical in NWChem Started By : Rana	1	391	Sep 3rd 1:02 pm Edoapra
`Compilation faied for nwchem-6.3.revision2-src.2013-10-17 with undefined reference Started By : Sri4mailing	12	611	Sep 2nd 8:13 pm Sri4mailing
Using Fragment Guess to get coupling between MOs? Started By : Cmjohns6	0	367	Sep 1st 1:18 pm Cmjohns6
ERROR installing nwchem 6.3 on RHEL !!! Started By : Neo	1	395	Aug 26th 8:30 am Neo
Geometry optimizations that won't converge Started By : Kpelzer	5	479	Aug 25th 10:24 am Kpelzer
Vectors for further analysis Started By : Vojtech.vlcek	0	209	Aug 24th 10:32 am Vojtech.vlcek
Problem with DIRDYVTST calculation Started By : Rana	6	439	Aug 23rd 7:25 am Rana
Link NBO to NWCHEM 6.3 Started By : Nazari	0	374	Aug 16th 9:22 pm Nazari
QA tests failing Started By : Eberrios	4	508	Aug 13th 4:17 pm Mernst
SCF convergence failure Started By : Chun-hung.wang	0	305	Aug 12th 3:38 pm Chun-hung.wang
Difference between ESP from task property and task esp Started By : Mime	0	293	Aug 11th 6:12 am Mime
Hamiltonian Matrix Elements and Overlap Matrix Elements Started By : Cmjohns6	0	381	Aug 9th 3:15 pm Cmjohns6
About NBO-6.0 Started By : Rintontin	0	455	Jul 31st 6:21 pm Rintontin
Why does nwchem give different results from Molpro does? Started By : Zfang	9	541	Jul 31st 2:08 pm Zfang
error in installing Started By : Lovi	6	588	Jul 27th 2:25 pm Mernst
DPlot: movecs_read_header failed Started By : Aggie2015	2	450	Jul 23rd 9:50 am Aggie2015
What is xc hfexch ? Started By : Nazarov	0	394	Jul 13th 9:59 pm Nazarov
rodft, frequency calculation Started By : Sujitha	5	591	Jul 10th 9:53 am Edoapra
MP2 density in gaussian cube format Started By : Kgk	4	647	Jul 8th 12:55 am Kgk
How to make geometry optimization calculation faster Started By : Chun-hung.wang	2	506	Jul 5th 9:50 pm Chun-hung.wang
Convergence issues with DFT Started By : Moretto	2	469	Jul 3rd 1:21 am Moretto
Reproducibility issue with SODFT Started By : Faycal	3	751	Jun 22nd 2:09 am Mernst
excited state electron densities from RT TDDFT Started By : Perkinsj	0	331	Jun 10th 9:30 am Perkinsj

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