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On Fri, Apr 29, 2011 at 3:49 AM, Stefano de Gironcoli
wrote:
> Dear all,
>
> ? ? I inquired Timo Thonhauser (now Wake Forest ?University), the main
> character behind the vdW-DF functional implementation in Quantum
> ESPRESSO, ?about the issue of the spin-polarized version of vdW-DF.
>
> I'm
Dear all,
I inquired Timo Thonhauser (now Wake Forest University), the main
character behind the vdW-DF functional implementation in Quantum
ESPRESSO, about the issue of the spin-polarized version of vdW-DF.
I'm reporting his opinion below:
"In general, at the moment there exists NO
On Apr 29, 2011, at 1:42 , wumindt2 wrote:
> Since i didn't collect the wavefunctions, the wavefunction files
> and the *.save file are in two different directory.
> To do the dos calculation, i set the 'outdir' as the directory of
> wavefunctions. But then i got an error saying that the *.save
rum at pwscf.org
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Bahawalpur, Pakistan
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