Re: Bader wfn file

Posted by David on September 19, 2017 at 19:05:55:

In Reply to: Re: Bader wfn file posted by Fabio Penotti on June 20, 2013 at 14:49:31:

Good day Coen, Xiaoge and Penotti!
May I also have a copy of this fortran file?
Thank you very much in advance and my best regards,
David

: : : : Does someone have a file conversion utility to write
: : : : out .wfn files for Bader`s AIM thory and is willing to share it?

: : : Yes, I made one. I can send you the fortran file that generates a WFN file
: : : from the RasOrb file (or any other file containing natural orbitals).

: : : Coen

: : Hello,

: : May I have a copy of this fortran code?

: : Many thanks!

: : Xiaoge

: Hello Coen.

: May I also have a copy of this Fortran file?

: Many thanks,

: Fabio

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Comments:
: : Good day Coen, Xiaoge and Penotti! : May I also have a copy of this fortran file? : Thank you very much in advance and my best regards, : David : : : : : : Does someone have a file conversion utility to write : : : : : out .wfn files for Bader`s AIM thory and is willing to share it? : : : : Yes, I made one. I can send you the fortran file that generates a WFN file : : : : from the RasOrb file (or any other file containing natural orbitals). : : : : Coen : : : Hello, : : : May I have a copy of this fortran code? : : : Many thanks! : : : Xiaoge : : Hello Coen. : : May I also have a copy of this Fortran file? : : Many thanks, : : Fabio

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