[CP2K:3655] non-orthorhombic cell

zafer maşlakcı zaferm... at gmail.com
Sat Dec 3 11:12:01 UTC 2011


I started a new, and what you do not know where to put my full well cp2k.
For this reason, I could not find the method called NYI cp2k page. I do not
know what to do

2011/12/3 Teodoro Laino <teodor... at gmail.com>

>
> On Dec 3, 2011, at 11:20 AM, face66 wrote:
>
> > Hi ,
> >
> > I want to run for the trajectory of the non-orthorhombic cell with the
> > construction.
> > but it gives the error mentioned below. What should I do to correct
> > this error.
>
> The error says:
>
> > non-orthorhombic cell with the selected method NYI
>
>
> so what you should do is to implement it.
>
> > What I need to add the input file.
> > Waiting for your help.
> >
> > *** ERROR in qs_localization  ***
> > *
> >
> >
> > *** non-orthorhombic cell with the selected method NYI  ***
> >
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