[Pw_forum] vc-relax newbie question

Paolo Giannozzi giannozz at nest.sns.it
Mon May 28 11:14:45 CEST 2007

On May 27, 2007, at 14:57 , mbaris at metu.edu.tr wrote:

> I am required to find lattice constant of the Pd crystal several  
> times.
> As suggested, due to simplicity, this can be done by interpolating a
> volume vs. E curve, but my previous experience with other programs
> suggest that this is rather inefficient if not inaccurate.

my previous experience suggests the opposite, at least for a simple

Paolo Giannozzi, Democritos and University of Udine, Italy

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