other atoms

Daniel Brue brue at nhn.ou.edu
Mon Jun 10 20:31:00 BST 2002


I appended the 'davidson' card to the fci calculation and it has produced exactly the 
results I want, but I've only been able to get it to work for helium. All other atoms
I have tried produce an error unless 'davidson,,,...' is commented out. How do I adapt 
this for other cases? Thanks!

Daniel Brue



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