MD simulation of System which include of Nafion ionomer, NaCl, CH3OH, SiO2 fragment, H3O+ in the same time.

[Dj MG]

OK thank you Mr. Conrad.
This is my input file, i have no idea about the sigma and epsilon value. 
And any person can check my input file may there are some false paramater?
My goal is looking for proton transport through grotthus mechanism using 
AIMD.

Thank you
Cheers Always
DJ MG 

On Monday, July 4, 2016 at 9:03:39 PM UTC+7, Dj MG wrote:
>
> Hi all cp2k lovers I'm DJ MG want to ask the input file (file.inp) what i 
> should create for my system which include of Nafion ionomer, NaCl, CH3OH, 
> SiO2 fragment, H3O+.
> My goal is looking for proton conductivity through Grotthus and SCI-MS-EVB 
> mechanism.
> My simulation will be running using AIMD and QMMM, but i prefer only using 
> AIMD to save my time.
> Can you suggest the input file for me or can you created file.inp for me 
> voluntarily?
> I have been running my file.inp file which was created by myself but i'm 
> not happy with the result.
>
>
> Best Regards
> Cheers All
> DJ MG
>
>
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