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Displaying 10 results for: Alessandro.chiesa Topics
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Thread Title | Replies | Views | Last Action | Forum |
Problems in compiling NWChem Started By : Alessandro.chiesa |
12 | 139 | Oct 5th 2:15 am Alessandro.chiesa |
Compiling NWChem |
Adding a charge to a DFT calculation Started By : Alessandro.chiesa |
2 | 1079 | May 7th 5:03 am Dot matrix madness |
NWChem functionality |
Geometry optimization Started By : Alessandro.chiesa |
0 | 234 | Apr 2nd 6:42 am Alessandro.chiesa |
NWChem functionality |
Molecules with odd number of electrons Started By : Alessandro.chiesa |
0 | 207 | Apr 1st 11:57 pm Alessandro.chiesa |
NWChem functionality |
Constrained DFT Started By : Alessandro.chiesa |
1 | 864 | Nov 12th 10:35 am Edoapra |
NWChem functionality |
Basis projection Started By : Alessandro.chiesa |
6 | 1016 | Oct 14th 10:27 am Edoapra |
NWChem functionality |
Plot atomic orbitals Started By : Alessandro.chiesa |
2 | 922 | Jun 7th 1:31 am Alessandro.chiesa |
NWChem functionality |
Plotting orbitals Started By : Alessandro.chiesa |
5 | 2995 | Dec 5th 11:14 am Bert |
NWChem functionality |
Foster-Boys Orbital Localization Started By : Alessandro.chiesa |
3 | 2248 | Sep 6th 9:46 am Bert |
NWChem functionality |
Convert NWChem output to GAMESS Started By : Alessandro.chiesa |
1 | 1346 | Sep 6th 9:39 am Bert |
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