NWChem functionality

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Topics related to current and future functionality of NWChem
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Announcement's Replies Views Last Action
Bug in Raman code
Started By : Sean
0 1909 Feb 2nd 6:45 pm
Sean
NWChem 6.6: bug in geometry optimization
Started By : Edoapra
0 1975 Jan 28th 2:50 pm
Edoapra
Sticky: NWChem 6.6 available for download
Started By : Edoapra
0 5477 Oct 20th 4:12 pm
Edoapra

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Thread Title Replies Views Last Action
DFT-D in Nwchem
Started By : Strutynski.karol
3 3079 Jan 24th 7:59 am
Strutynski.karol
Spin-orbit coupling martrix elements calculation with NWchem
Started By : Xyzzz986
1 3344 Dec 12th 8:51 pm
Niri
basis sets for relativistic NESC
Started By : Zork
1 2796 Oct 28th 5:03 pm
Bert
Fix for S4 symmetry with NWChem 6.0
Started By : Niri
0 2643 Oct 26th 12:19 pm
Niri
DNTMC
Started By : Guest -
1 1884 Oct 18th 10:34 am
Guest -
Welcome..
Started By : WikiSysop
0 2040 Sep 3rd 9:49 am
WikiSysop

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