[CP2K-user] [CP2K:11243]

[Akshay Malik]

Dear Patrick,

I have used VMD to analyze the trajectory file but I am not able to see the
quantum effects such as proton transfer in CPK Representation but in
DynamicBonds representation there is some sort of bond making and breaking.
Can I consider DynamicBonds representation as quantum effects?

On Fri, Feb 8, 2019 at 4:37 PM Patrick Gono <patric... at gmail.com> wrote:

> Dear Akshay,
>
> I suggest VMD, which can be found at https://www.ks.uiuc.edu/Research/vmd/
>
> Yours sincerely
> Patrick Gono
>
> On Fri, 8 Feb 2019 at 05:35, Akshay Malik <akshayma... at gmail.com>
> wrote:
>
>> I have done AIMD of liquid water by using cp2k. I want to see the bond
>> breaking and proton transfer by grotthuss mechanism. Please suggest some
>> visualisation softwares.
>>
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