Posted by claudiu on June 12, 2013 at 11:08:24:
I am trying to run a MEP including solvent effects. However, when MCLR is called I get a message like "mclr does not converge for pertirbation nr 1, increse nr. it.". I do it manually and set the nr. it. to even 1000 and still no convergence. Is there another keyword for mclr in this case? or just simply doesn't work with PCM?
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