[Pw_forum] Bonding nature Na-C

[Sanjeev Gupta]

Hi,
you may perform the charge calculation and look insight.

thanks
sanjeev


On Tue, Nov 25, 2014 at 5:17 AM, Barnali Bhattacharya <
barnalidgbhatt at gmail.com> wrote:

> Dear  QE user,
>
> I am doing some calculation with sodium absorbed graphene. I want to see
>  whether the Na-C bond is more metallic or more covalent. Using QE how
> can I do it?
>
> Could anybody please guide me?
>
> Sincerely
>
> Barnali  Bhattacharya
>
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-- 
With Best Regards,

------------------------------------
Dr. Sanjeev Kumar Gupta
Fulbright Post-Doctoral Scholar
Dept. of Physics
Michigan Technological University
1400 Townsend Drive, Houghton
MI 49931, USA
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