[QE-users] local electron attachment energy or electron affinity

Максим Арсентьев ars21031960 at gmail.com
Sun May 9 22:31:50 CEST 2021


Dear QE users,

How to get local electron attachment energy or electron affinity with pp.x?
Am I right what local electron attachment energy  is the same as electron
affinity?
I took these terms from work of  J.H. Stenlid et al. [J.H. Stenlid, A.J.
Johansson, T. Brinck, Phys. Chem. Chem. Phys., 2019,21, 17001-17009].
https://pubs.rsc.org/en/content/articlelanding/2019/cp/c9cp03099a#!divAbstract


--
Best wishes,
Maxim Arsent'ev, Ph.D. (Chemistry)
Laboratory of research of nanostructures
Institute of Silicate Chemistry of RAS
St-Petersburg, Russia.
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