[Pw_forum] Calculation of transition dipole moment

Huy Pham pchuy1906 at gmail.com
Wed Feb 15 01:19:53 CET 2017


Dear QE users,

I want to calculate the transition dipole moment between conduction and
valence bands for an isolated molecule using QE. I searched the forum but
didn't find much information.
Can anyone give me some suggestions?

Thanks,
Huy

-- 
Huy Pham, PhD
Postdoctoral Researcher
Department of Chemistry and Biochemistry
University of California, San Diego
9500 Gilman Drive
Urey Hall 4205
La Jolla, CA 92093
E-mail:
pchuy1906 at gmail.com
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