[CP2K-user] [CP2K:12637] Re: output trajectory not periodic by setting "PERIODIC XYZ-POISSON"

[lizzy bai]

Dear Prof. Travis

Thank you very much for you information.
I have formated the trajectory as DCD. Then the outfile only has DCD file,
no xyz file. The following keywords I used as below:
 &TRAJECTORY
       FORMAT DCD
     &EACH
       MD 1
     &END EACH
   &END TRAJECTORY

Best regards

Liyi

Travis <polla... at gmail.com> 于2019年12月13日周五 下午10:45写道：

> Hi,
>
> You load an XYZ first. Then load DCD as additional data. DCD doesn't
> contain atom names.
>
> -T
>
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