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Displaying 11 results for: Alessandro.chiesa Topics
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Thread Title Replies Views Last Action Forum
Convergence problems with Au cluster1 2
Started By : Alessandro.chiesa
17 1689 Sep 9th 8:06 pm
Xiongyan21
Running NWChem
Problems in compiling NWChem
Started By : Alessandro.chiesa
14 1385 Nov 29th 8:25 am
Alessandro.chiesa
Compiling NWChem
Adding a charge to a DFT calculation
Started By : Alessandro.chiesa
2 1602 May 7th 5:03 am
Dot matrix madness
NWChem functionality
Geometry optimization
Started By : Alessandro.chiesa
0 754 Apr 2nd 6:42 am
Alessandro.chiesa
NWChem functionality
Molecules with odd number of electrons
Started By : Alessandro.chiesa
0 723 Apr 1st 11:57 pm
Alessandro.chiesa
NWChem functionality
Constrained DFT
Started By : Alessandro.chiesa
1 1552 Nov 12th 10:35 am
Edoapra
NWChem functionality
Basis projection
Started By : Alessandro.chiesa
6 1961 Oct 14th 10:27 am
Edoapra
NWChem functionality
Plot atomic orbitals
Started By : Alessandro.chiesa
2 1383 Jun 7th 1:31 am
Alessandro.chiesa
NWChem functionality
Plotting orbitals
Started By : Alessandro.chiesa
5 4888 Dec 5th 11:14 am
Bert
NWChem functionality
Foster-Boys Orbital Localization
Started By : Alessandro.chiesa
3 3199 Sep 6th 9:46 am
Bert
NWChem functionality
Convert NWChem output to GAMESS
Started By : Alessandro.chiesa
1 2008 Sep 6th 9:39 am
Bert
General Topics

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