[Pw_forum] Projections of quantum number

Jiantuo Gan jiantuo.gan.691 at gmail.com
Thu Dec 8 07:21:40 CET 2016


Hi,

I am programming for Perovskite materials, which has usually a CH3NH3PbCl3
chemical structure.
I am having a problem with projection of orbitals.

Can anyone please tell how I should prepare programme for projection for
this complicated structure. Or please anyone put projection of orbitals in
a simple way. What is the essence here? Thanks a lot!
-- 
Yours sincerely,
J. Gan

PhD Thin Film Solar Cells, University of Oslo 2012-2015
MSc Nanoscience, Lund University 2010-2012
BSc Materials Physics Hebei University of Technology 2006-2010
Tel: +47 96855568
Linked in:http://se.linkedin.com/pub/jiantuo-gan/31/960/454
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