From: Nuno A. G. B. <nun...@is...> - 2007-03-18 23:02:35
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I just noticed, browsing through the ADF manual that SFO analysis is not produced with spin orbit runs so naturally there will be nothing for the parser to read in that case. -- Nuno A. G. Bandeira, AMRSC Graduate researcher and molecular sculptor Inorganic and Theoretical Chemistry Group, Faculty of Science University of Lisbon - C8 building, Campo Grande, 1749-016 Lisbon,Portugal http://cqb.fc.ul.pt/intheochem/nuno.html Doctoral student @ IST,Lisbon -- |