[CP2K-user] [CP2K:18726] Re: tensile loading simulation with cp2k, how to apply a strain rate in one dimention of cell?

wenxue ma yiqingyangk at gmail.com
Thu Apr 27 02:22:42 UTC 2023


Dear user,

I have just learned CP2K for few months. I have met the same problems, I 
want to konow how to apply a constant strain for a system. We want to 
calculate the strain-stress curves. Do you solve your problems? Could you 
offer some advice for this question? 
Thank you for your reply.

Qi 在 2020年7月14日 星期二晚上7:01:09 [UTC+8] 的信中寫道:

> Hi,
> ZHONG
>
> I meet the same question with you. Do you have any idea about increase 
> cell dimention in a fixed rate during MD now?
>
> Best regards,
> Qi
>
>
> 在 2020年1月14日星期二 UTC+8下午10:05:09,Scenery写道:
>
>> Dear cp2k users,
>>
>> Just like the title i wrote.
>>
>> How to increase cell dimention in a fixed rate during MD.
>>
>> Best regards,
>> ZHONG Jing
>>
>

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