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Displaying 7 results for: Mdsimulationgroup Posts
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Projecting small basis with ECP?
Started By : Mdsimulationgroup
3 126 Feb 12th 11:35 am
Edoapra
Running NWChem
CCSD(T) Opt stops at Step 0
Started By : Mdsimulationgroup
1 136 Dec 18th 1:12 pm
Mdsimulationgroup
Running NWChem
HF SCF Oscillating and Failling
Started By : Mdsimulationgroup
1 106 Dec 18th 12:20 pm
Mdsimulationgroup
Running NWChem
TDDFT Error with "xc new m06-2x"
Started By : Mdsimulationgroup
3 187 Dec 11th 10:58 am
Edoapra
Running NWChem
PSPW Car-Parrinello Recentering Starting Geometery
Started By : Mdsimulationgroup
2 191 Nov 28th 6:36 am
Mdsimulationgroup
Running NWChem
NWPW Lattice Units?
Started By : Mdsimulationgroup
4 197 Nov 20th 1:31 pm
Bylaska
NWChem functionality
nw_rtparse.py
Started By : Fatemeh
1 322 Sep 2nd 5:35 am
Fatemeh
General Topics

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