[CP2K:3654] non-orthorhombic cell

Teodoro Laino teodor... at gmail.com
Sat Dec 3 11:23:53 CET 2011


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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