[Pw_forum] Counterpoise correction

Francis Jing francijing at gmail.com
Thu May 29 12:08:06 CEST 2014


Thank you Ari, Tone, and Giovanni, for your kind responses.

May I further ask, is there any situation in which pseudopotential for
ghost atoms should be defined? I am confused since a post in this forum
talked about this topic.
http://qe-forge.org/pipermail/pw_forum/2014-February/103342.html


Francis
-- 
Zhifeng (Francis) Jing
Graduate Student in Physical Chemistry
School of Chemistry and Chemical Engineering
Shanghai Jiao Tong University
http://sun.sjtu.edu.cn
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