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by leonardo
17 Nov 2015, 17:52
Forum: Running LSDalton
Topic: ECD spectrum of a large molecule
Replies: 1
Views: 7399

ECD spectrum of a large molecule

Hi LSDalton users, I'm studying the dichroic response of large molecules. I successfully managed to run dalton and the results on small benchmark systems are really good. However because the size of my system (around 600 electrons) LSdalton seems to be more convenient for my research. I've tried to ...