Multiwfn official website: //www.umsyar.com/multiwfn. Multiwfn forum in Chinese: http://bbs.keinsci.com/wfn
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Dear Tian Lu
Thank you for your suggestion, now the software is working properly according to the updated settings.ini
Dear Sir/Madam,
I am new to Multiwfn, and I just installed Multiwfn. I was reconfiguring the settings.ini file to change the number of threads by changing the default value from 4 to 24, but Mutiwfn failed to recognize the change when I run it afterwards. I also tried other parameters (bndordthres) but it failed to change when I run as well. I also checked my syntax is according to the comment in the settings.ini file. May I know what could be the issue?
Thank you in advance!
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