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Locked Sticky: NWChem 6.8 available for dowload
Started By : Edoapra
0 1494 Dec 14th 2:51 pm
Edoapra

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QM/MM questions
Started By : Marat
0 3437 Sep 23rd 2:13 pm
Bug
ZORA and ECP
Started By : Guest -
1 2076 Sep 22nd 10:46 am
Bert
units for linear response
Started By : Guest -
2 1830 Sep 16th 3:50 pm
Niri
tolerance in CPHF module
Started By : Guest -
5 3217 Sep 16th 5:54 am
Guest -
Convert NWChem output to GAMESS
Started By : Alessandro.chiesa
1 2360 Sep 6th 9:39 am
Bert
vacuo directive in MD
Started By : Guest -
1 1637 Aug 26th 2:06 pm
Guest -
metals with prepare
Started By : Guest -
0 1477 Aug 25th 5:28 am
Guest -
Problem with "Save Preferences"
Started By : HUWagner
1 1786 Aug 19th 3:14 pm
Bert
Dimension msa too small
Started By : Guest -
1 2127 Aug 19th 3:05 pm
Bert
run DFT using ROHF wavefunctions
Started By : Guest -
1 2381 Aug 18th 6:16 am
Niri
Installing ECCE Client
Started By : Guest -
1 2044 Aug 16th 1:55 pm
Bert
How/where can I get a pdf copy of the user' manual/programmer's guide for NWChem 6.0
Started By : Guest -
1 2380 Aug 2nd 5:03 pm
Bert
Excited state calculation
Started By : Rand
2 1867 Aug 2nd 5:03 pm
Niri
eastimaed standard error in QM/MM free energy perturbation method
Started By : Guest -
1 2449 Aug 2nd 5:02 pm
Bert
to generate topology file for qmmm
Started By : Guest -
2 2015 Aug 2nd 5:01 pm
Bert
vdW parameter unit for NWCHEM
Started By : Yt82
1 1935 Aug 2nd 5:00 pm
Bert
nwchem hangs before dft scf
Started By : Pvallett
2 2166 Aug 2nd 4:52 pm
Bert
Ionization potential of Pd using ECP28MDF
Started By : Brynetan
4 2486 Jul 21st 7:47 pm
Brynetan
qmmm free energies
Started By : Guest -
3 2194 Jul 20th 5:38 pm
Marat
what is the unit of "oscillator strength"
Started By : Guest -
1 6712 Jul 7th 12:16 pm
Guest -
"too many files open" error
Started By : Matrix2010
1 2756 Jul 6th 3:14 pm
Bert
ROMP2 calculation
Started By : Guest -
1 2212 Jul 6th 3:10 pm
Bert
read basis set
Started By : Guest -
3 3290 Jul 6th 3:07 pm
Bert
QM/MM with no MM parameters
Started By : TeoT
2 1803 Jul 1st 12:39 am
TeoT
Calculating Energies and Enthalpies
Started By : Guest -
1 5599 Jun 28th 10:23 am
Guest -
ECP60MDF
Started By : Brynetan
7 4636 Jun 22nd 2:17 pm
Guest -

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