Electrical Field issue

[Pankaj Mishra]

Dear Yang, 

There is a possibility of  bug in EFIELD routine. There is a discussion in 
the group that may help you.

https://groups.google.com/forum/#!searchin/cp2k/Efield/cp2k/kH_a6k21FLQ/IZAphZhKtkMJ

Enjoy 

Regards-
Pankaj
 

On Tuesday, 10 June 2014 13:52:30 UTC+2, Yiming Yang wrote:
>
> Dear CP2K users,
>
> I want to study a system of a molecule on the surface of Si(100).
>
> Now, I am trying to apply electrical field or electrical pulse to approach 
> the experimental results.
>
> But when I wrote in my input file as followed, it turns out error.
>
>       &EFIELD
>          ENVELOP RAMP
>          INTENSITY 4E+07
>          POLARISATION 0.0 0.0 1.0
>          &RAMP_ENV
>          END_STEP_IN    25
>          END_STEP_OUT   35
>          START_STEP_IN  20
>          START_STEP_OUT 30
>          &END
>       &END EFIELD
>
> I will attach my input file with this topic.
>
> Thanks in advance
>
> Yiming
>
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