[Pw_forum] Questions about generating pseudopotential by ld1.x

Aditya Vishwakarma macs12adi1996 at gmail.com
Thu Jun 15 12:29:48 CEST 2017


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
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