[Pw_forum] Stress calculation in quantum espresso

Huiqun Zhou hqzhou at nju.edu.cn
Tue Jun 30 05:22:06 CEST 2009


But at least, this kind of description is a bit of  misleading. 


Huiqun Zhou
@Earth Sciences, Nanjing University, China

> +--------------------------------------------------------------------
>   Variable:       tstress
> 
>   Type:           LOGICAL
>   Description:    calculate stress. Set to .TRUE. if calculation='vc-md'
>   +--------------------------------------------------------------------
> The last sentence does not mean that the variable applies just to a 
> vc-md calculation but  that
> it is by default set to .true. in that case.





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