[Wien] Reg: bader analysis

Swetarekha Ram swetarekharam at gmail.com
Sun Sep 23 19:29:20 CEST 2012


Dear Wien2k users,


I am trying to analyse the charge transfer inside the molecule. For that I
ran the AIM programme.
I got the out put. But My doubt is, how can I get the amount of charge
transfer from the one atom to another.

I have seen in many paper, where people used to plot the charge density
plots with the label amount of charge transferred by the individual atom.

I need some suggestion.

And also I need some help regarding details about the AIM programme.

-- 
Swetarekha Ram,
Research Scholar,
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