[CPMD-list] Ag PP

[alex.msilva]

Hi,

   I´m trying to obtain some results for a 
little Ag cluster, so I must to generate a PP 
for this atom, using the Gianozzi´s code. After 
that, I have done some tests to validate this 
PP. I found that a simple optimization 
wavefunction calculation were evaluated after a 
slow convergence of more than 100 steps. Is this 
wrong? What can I do to improve this PP?


Alexander.
 
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