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: [email protected]
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