Geometry optimizations that won't converge


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Quote:Edoapra Aug 22nd 9:39 am
I have found no problem running your input file.
What version of NWChem have you been using?
Could you post your output file to a website?
There might be issue with the NWChem installation you are using


I am using version 6.1.1. Do you have any suggestions on a website that I could post my output file to? I am not sure how to do this.

Thanks very much for your help.