Dear all, I am new to qe and want to learn to generate pseudopotential on my own. Can you suggest why do they put negative signs in the configuration of Si in &inputp. Does that have any significance of an atom in solid.?( I am just curious to know)
Also, How can I choose more ionic configurations. Thanking You, Aditya Vishwakarma Under Graduate Student College Of Engineering, Pune
_______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
