Re: [SIESTA-L] As pseudo GGA

2008-09-26 Thread Giacomo Giorgi
Thank you very much, G On Thu, 25 Sep 2008, Oleksandr Voznyy wrote: pe Gallium tm2 2.1 Ga pbr 0.0 0.0 0.0 0.0 0.0 0.0 64 40 2.00 0.00 41 1.00 0.00 42 0.00 0.00 43 0.00

Re: [SIESTA-L] As pseudo GGA

2008-09-25 Thread Oleksandr Voznyy
pe Gallium tm2 2.1 Ga pbr 0.0 0.0 0.0 0.0 0.0 0.0 64 40 2.00 0.00 41 1.00 0.00 42 0.00 0.00 43 0.00 0.00 2.10 2.50 3.00 3.00 1.10

[SIESTA-L] As pseudo GGA

2008-09-25 Thread Giacomo Giorgi
dear all, I would like to perform some calculations on bulk GaAs. I found tested pseudo and basis for Ga. I wonder if someone can share tested pseudo and basis for As. Thanks in advance, Giacomo -- * * * * * * * * * * * * * * * * * * * * * * * * * * Giacomo Giorgi