Re: unit dipole moment vector

From: The Cromicus Productions (thecromicusproductions_at_gmail.com)
Date: Fri May 11 2018 - 13:11:13 CDT

Dear Suresh,

I use VMD to do that. VMD > Extensions > Visualization > Dipole Moment
Watcher
That will give you the dipole moment in units of Debye and you can write a
code (or use excel)
to normalize it.

Regards,

Sebastian

On Fri, May 11, 2018 at 3:58 AM, Suresh Ghimire <
suresh.ghimire2049sg_at_gmail.com> wrote:

> Dear namd user,
> How can we calculate the unit dipole moment vector of all water molecules
> with respect to the CNT surface?
>
> --
> Regards
> Suresh Ghimire
> M Sc (Physics)
> Tribhuvan University, Patan Multiple Campus
> Lalitpur, Nepal
>

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