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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
APPLICATION TERMINATED WITH THE EXIT STRING.... Started By : Mhiranya	1	845	Apr 8th 7:11 pm Huub
Understanding Numerical Gradients with TD-DFT Started By : Pvallett	1	653	Apr 8th 6:39 pm Huub
RESP example?? Started By : Grad	1	850	Apr 8th 6:31 pm Huub
HOMO-LUMO gap in Aun Started By : Alfcanova	1	682	Apr 8th 6:27 pm Huub
run frozen or is it normal Started By : Elvis	1	396	Apr 8th 6:05 pm Huub
SARC-ZORA @ nwchem 6.0 Started By : Elvis	1	508	Apr 8th 5:59 pm Huub
how to put a charge in a certain atom Started By : Tfliu	1	347	Apr 8th 5:37 pm Huub
failed convergance for a single atom Started By : Alexx	1	561	Apr 8th 5:27 pm Huub
molecular orbitals Started By : Sujitha	3	514	Apr 4th 1:36 pm Sujitha
Numerical result out of range Started By : Aggie2015	0	637	Mar 27th 1:20 pm Aggie2015
NWCHEMRATE Started By : Manu nwchem	0	455	Mar 25th 1:14 pm Manu nwchem
NWChem 6.3 GPU support Started By : Jwkeller	1	694	Mar 24th 12:32 pm Edoapra
Cannot post to ECCE forum Started By : WillEverett	1	369	Mar 19th 12:17 pm WillEverett
All-Electron calculation for Gold Started By : Elvis	2	691	Mar 19th 12:52 am Elvis
dummy charge for help Started By : Tfliu	1	391	Mar 18th 5:23 pm Tfliu
ET model for help Started By : Tfliu	5	530	Mar 17th 5:06 pm Tfliu
run spherical atom with evenly distributed valence electron Started By : Alexx	1	799	Mar 14th 2:07 pm Edoapra
CCSD(T) error Started By : Manu nwchem	2	457	Mar 14th 9:53 am Edoapra
dft optimization failed Started By : Mhiranya	1	527	Mar 12th 10:08 am Mhiranya
unknown field hyperbolic Started By : Grad	2	364	Mar 12th 6:29 am Grad
mult value calculation for the DFT-NEB calculation Started By : Sanjib	3	854	Mar 10th 5:01 pm MattZ
calculation of electronic coupling for help Started By : Tfliu	2	580	Mar 7th 12:17 am Tfliu
Please suggest Ultrasoft Pseudopotential for Cerium Started By : Harsh Somani	0	419	Mar 6th 3:39 am Harsh Somani
Are these definitions correct for the functionals I am trying to define? Started By : Beulahsu	7	3832	Mar 4th 12:15 am Ohlincha
NWChem Example Started By : Hong420	1	974	Feb 21st 2:20 pm Philip007

Forum >> NWChem's corner >> General Topics

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