[gmx-users] Setting a electric field in a simulation

[David van der Spoel]

Den 2020-03-10 kl. 03:17, skrev Mijiddorj B:
> Dear GMX users,
> 
> I would like to perform MD simulations of solutions applying electric
> fields such as the microwave heating process.  Is it possible to perform in
> gromacs?
> 
> 1. How can I set the external electric field in the simulations?
> (from the user guide, I understood that I need to set 4 values
> 
> electric-field-x = 2.0  150     5     0
> 
> How can I adjust the 2.45 GHz frequency?
> 
> If you do not mind, please guide me.
> 
> Best regards,
> 
> Mijiddorj
> 
Why don't you try to play around and check the output file field.xvg to 
see what frequency you get?

-- 
David van der Spoel, Ph.D., Professor of Biology
Head of Department, Cell & Molecular Biology, Uppsala University.
Box 596, SE-75124 Uppsala, Sweden. Phone: +46184714205.
http://www.icm.uu.se