[Wien] how to inculde more value electron in Wien2k
Wei Zhou
zdw2000 at gmail.com
Thu Jun 18 01:26:18 CEST 2009
dear usrs;
I want to take more empty shell consideration into , that
is including more electrons for showing the density of state.
for example ; Na is 2p63s1, I want to take the 3p and 3d electron
into consideration,
so how can I do for this, any help will be appreciated
best wishes
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