Posted by Rina Rani Bhowmick on October 30, 2020 at 20:27:00:
In Reply to: Re: Bader wfn file posted by Coen de Graaf on January 27, 2009 at 09:53:25:
: : Does someone have a script for converting RasOrb file to wfn file?:
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if B is 1s22s22p1, what is Li?
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Comments: : : : Does someone have a script for converting RasOrb file to wfn file? : :