[CP2K-user] Basis set and functional for Cs-Pb-Br Perovskite structure

Nikhil Maroli scin... at gmail.com
Sat Aug 31 09:57:25 UTC 2019


Dear all,

I would like to study the CsPbBr based quantum dot using CP2K. can anyone
suggest me a basis set for Cs atom.


-- 
Regards,
Nikhil Maroli
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