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Thread Title	Replies	Views	Last Action	Forum
Compiling NWChem on Cygwin Started By : P99	14	235	Jun 20th 1:57 am Ivo	Compiling NWChem
NWChem-6.3 (2013-05-28) on SUSE Linux Started By : Tz	4	41	Jun 20th 1:57 am Tz	Compiling NWChem
Gaussian orbital dft in Nwchem 6.3 Started By : Sm00469	2	9	Jun 19th 5:30 pm Bert	Compiling NWChem
Problem with the Vxc matrix Started By : Boulange	5	27	Jun 19th 5:26 pm Bert	General Topics
Can NWChem be compiled usingc99? Started By : WillEverett	2	65	Jun 13th 9:45 am WillEverett	Compiling NWChem
SO-DFT calculations. Started By : Ssingh chem	1	47	Jun 7th 2:14 pm Bert	General Topics
Plot atomic orbitals Started By : Alessandro.chiesa	2	70	Jun 7th 1:31 am Alessandro.chiesa	NWChem functionality
CCSD iterations does not converge Started By : Rusun	4	170	Jun 7th 12:12 am Jhammond	General Topics
Spherical vs cartesian basis sets Started By : Guest -	2	799	Jun 7th 12:08 am Jhammond	NWChem functionality
Preconditioned conjugate gradient SCF Started By : Susilehtola	4	54	Jun 4th 5:27 pm Niri	General Topics
COSMO and UHF? Started By : Beckmw	8	299	Jun 3rd 12:31 pm MSiebert	General Topics
DFT-D3 (vdW 3) Question Started By : Ham Squad	3	48	May 30th 12:39 pm Bert	NWChem functionality
Plane wave DFT- crystal optimizations Started By : Amorendt	1	44	May 29th 11:48 am Bert	NWChem functionality
natural orbitals Started By : Adam.k	4	180	May 29th 3:21 am Alessandro.chiesa	NWChem functionality
Frequency calculation for C70 fullerene crashing, do not understand error Started By : Kpelzer	3	102	May 28th 9:15 am Bert	General Topics
rodft and range separated-functional Started By : Goose99	3	106	May 24th 7:51 pm Goose99	Running NWChem
Geometry Optimization with COSMO Started By : Shireham	8	1293	May 24th 11:54 am Bert	NWChem functionality
electronic coupling from CDFT Started By : Tiechong	9	521	May 17th 3:39 pm Bert	Running NWChem
CCSD(T) issues with NWChem 6.1.1 Started By : Bert	6	159	May 16th 11:29 pm Uew	Running NWChem
Calculating delta G from frequency calculation. Started By : Beckmw	4	158	May 13th 3:46 pm Beckmw	General Topics
cannot post a message Started By : Uew	1	86	May 13th 2:17 pm Bert	Running NWChem
molecular orbitals conversion from .movecs to .txt Started By : Wl	2	147	May 13th 7:51 am Wl	General Topics
Point-Charge--Freq Started By : Shahabnaghavi	1	120	May 7th 12:21 pm Bert	NWChem functionality
optimization in DFT-D3 Started By : P99	3	140	May 7th 12:13 pm Bert	General Topics
VSCF PES for a linear molecule Started By : Andrewb	2	179	May 3rd 12:13 am Andrewb	General Topics
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