[gmx-users] Constant Potential on Walls of Electrodes

Alex nedomacho at gmail.com
Mon Jan 11 00:10:06 CET 2016


This was not a suggestion, but the answer to your question. You cannot 
specify a potential in GMX, only external fields.

Alex


On 1/10/2016 2:35 PM, Moradzadeh, Alireza wrote:
> Thank you for your suggestion but in case of Electric Double Layer it does not work.
>
>> On Jan 10, 2016, at 2:29 PM, Alex <nedomacho at gmail.com> wrote:
>>
>> You can't do that in Gromacs, only via effective electric fields.
>>> On Jan 10, 2016 1:24 PM, "Alireza Moradzadeh" <a.mrdzd at gmail.com> wrote:
>>>
>>> Hi,
>>>
>>> I want to simulate ions inside nanopore. How can I implement a constant
>>> potential on electrodes walls in gromacs.
>>> Thank you
>>>
>>> Best Regards,
>>> Alireza Moradzadeh
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