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Any kind of feedback: positive, negative, neutral, etc ... For example: I have tried ten times to download the tarball file for NWChem 6.5 and the download never completed in full
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Announcement's Replies Views Last Action
Locked Sticky: NWChem 6.8 available for dowload
Started By : Edoapra
0 6 Dec 14th 1:51 pm
Edoapra
Bug in Raman code
Started By : Sean
0 2053 Feb 2nd 5:45 pm
Sean
NWChem 6.6: bug in geometry optimization
Started By : Edoapra
5 2180 Jan 28th 1:50 pm
Edoapra
Sticky: NWChem 6.6 available for download
Started By : Edoapra
0 5669 Oct 20th 3:12 pm
Edoapra

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Thread Title Replies Views Last Action
Bug in density Laplacian calculation in nwdft
Started By : Dmejiar
2 31 Dec 8th 8:46 am
Dmejiar
availability of 6-311G titanium basis sets on PNNL BSE?
Started By : Alexbalboa
0 59 Nov 14th 9:27 am
Alexbalboa
ccCA reference energy calculation correction
Started By : Drhaney
0 114 Sep 11th 9:25 pm
Drhaney
ccCA code defect
Started By : Drhaney
1 162 Sep 7th 9:23 am
Edoapra
ESP (Electrostatic Potential in NWChem)
Started By : Matrix2017
1 199 Jul 18th 1:17 pm
Matrix2017
Basis Set Exchange website can't be opened
Started By : Anyeyu
2 141 Jun 28th 10:36 am
Edoapra
about wcut in nwpw_input?
Started By : Kwaldner
2 403 May 19th 3:02 pm
Bylaska
PSPW code seems to be completely broken
Started By : Yesint
7 428 May 19th 12:38 pm
Bylaska
rt-tdft example: Water TD-PBE0 resonant excitation
Started By : Mouse
1 602 Sep 29th 1:22 pm
Niri
use maintenance versions (6.6.1, 6.6.2) for critical patches
Started By : Den59
1 674 Aug 24th 12:52 pm
Den59
QMD Properties
Started By : Fteixeira
2 627 Aug 1st 9:37 am
Fteixeira
Need help for MP2 calculation
Started By : Sujala
3 941 Jul 11th 9:14 am
Sujala
radial densiity
Started By : Anand bharadvaja
0 676 Jun 1st 10:15 pm
Anand bharadvaja
Typo on Band Structure Paths on user's manual
Started By : Jud11
0 803 Mar 7th 9:37 pm
Jud11
total dft energy differs from partial energies
Started By : Stanos4
4 1379 Feb 26th 1:05 pm
Sean
TDDFT excited state gradients and optimizations - labels of roots when using symmetry
Started By : Rocfo
0 767 Jan 28th 4:33 am
Rocfo
N-N Bond Fragmentation
Started By : Iromkingman
0 861 Jan 19th 2:13 pm
Iromkingman
implementation of 1e- and 2e-integrals
Started By : Masoud
1 806 Jan 13th 1:56 pm
Mernst
abelian symmetry check subroutine is lacking groups ..
Started By : Jaapkroe
1 1333 Jan 8th 10:00 am
Edoapra
H2 @ direct CCSD(T)/6-31G* fails
Started By : Drhaney
5 1425 Nov 29th 10:30 am
Drhaney
Beta version of NWChem 6.6 available for download
Started By : Edoapra
4 2223 Oct 9th 6:12 pm
Edoapra
Possible error in TDDFT Gradient
Started By : Tristhaus
6 1721 Aug 11th 9:03 am
Niri
These are not the Hartrees you're looking for
Started By : Drhaney
0 1143 Jul 22nd 11:10 am
Drhaney
Correction: fundamental constants
Started By : Drhaney
0 1570 May 23rd 8:19 pm
Drhaney
Imported python modules can't call nwchem functions
Started By : Drhaney
2 1396 May 19th 5:20 am
Drhaney

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