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Displaying 7 results for: Rasmus Topics
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Thread Title Replies Views Last Action Forum
Spin contamination for calculations including iron
Started By : Rasmus
3 590 Feb 17th 9:47 am
Sean
Running NWChem
Expectation value of S2
Started By : Rasmus
0 615 Apr 15th 6:26 am
Rasmus
Running NWChem
error running nwchem_openmpi in parallel
Started By : Rasmus
2 3855 Mar 31st 12:34 am
Rasmus
Running NWChem
compiling conflict
Started By : Rasmus
2 774 Mar 30th 4:48 am
Rasmus
Compiling NWChem
Problems with frequency calculations
Started By : Rasmus
1 631 Feb 29th 9:12 am
Sean
Running NWChem
Transition state search from frequency calculation
Started By : Rasmus
3 635 Feb 9th 2:07 am
Rasmus
Running NWChem
removing constraints after constrained optimization
Started By : Rasmus
1 508 Feb 3rd 4:05 am
Rasmus
Running NWChem

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