[CP2K:461] Re: Annealing with NPT_F

Teodoro Laino teodor... at gmail.com
Thu Dec 6 21:35:00 CET 2007


Hi Rad,
Please check the message I sent a couple of hours ago.
QS does not identify a unique method.
It works for QS-GPW but does not work for QS-GAPW (pls check the  
settings of the keyword QS%METHOD).

teo

On 6 Dec 2007, at 21:28, Rad wrote:

> I am sorry, I forgot to mention that I am performing DFT QS
> calculations. Please confirm that stress tensor is working for QS

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