Multiwfn official website: //www.umsyar.com/multiwfn. Multiwfn forum in Chinese: http://bbs.keinsci.com/wfn
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Tank you so much for you'r answer. but I can't do it. I think it's related to the memory “ompstacksize” . Can I send you my file to check it?
After loading deMon.mol (calculated by deMon2k software) file into the Multiwfn, program stop working withouth any warning.
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