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Output of ECP matrix elements
Started By : Bob79
0 555 Jun 2nd 1:36 am
Bob79
Running NWChem
Modification in xc_getv.F
Started By : Bob79
0 966 Oct 3rd 12:55 am
Bob79
Compiling NWChem
Organic molecule plus dication
Started By : Bob79
0 1165 Sep 4th 3:49 am
Bob79
General Topics
Geometry optimization with DFT-D3
Started By : Bob79
4 1804 Sep 2nd 5:59 am
Bob79
Running NWChem
Compiling mov2asc fails
Started By : Bob79
7 3549 Aug 29th 8:14 pm
Vladimir
Compiling NWChem
User-defined External Potential
Started By : Bob79
0 1201 Jun 21st 11:29 pm
Bob79
NWChem functionality
Radial integration
Started By : Bob79
0 1351 Sep 15th 9:54 am
Bob79
NWChem functionality
Single iteration and dummy convergence
Started By : Bob79
1 1662 Sep 9th 10:03 am
Edoapra
Running NWChem
Suggestion for memory and integral storage
Started By : Bob79
0 1324 Sep 2nd 11:50 pm
Bob79
Running NWChem
Order of d and f functions in basis
Started By : Bob79
5 1734 Aug 30th 9:00 am
Edoapra
General Topics
Output of matrices: format and file
Started By : Bob79
0 1723 Aug 20th 10:59 pm
Bob79
General Topics
Some beginners questions
Started By : Bob79
2 2459 Dec 7th 12:58 am
Bob79
NWChem functionality

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