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cond-mat.mtrl-sci2022
Combining experiments on luminescent centres in hexagonal boron nitride with the polaron model and ab initio methods towards the identification of their microscopic origin
Moritz Fischer, Ali Sajid, Jake Iles-Smith +10
The two-dimensional material hexagonal boron nitride (hBN) hosts luminescent centres with emission energies of 2 eV which exhibit pronounced phonon sidebands. We investigate the mi…
cond-mat.mtrl-sci2022★ 16 cited
Spin coherence times of point defects in two-dimensional materials from first principles
A. Sajid, Kristian S. Thygesen
The spin coherence times of 69 triplet defect centers in 45 different 2D host materials are calculated using the cluster correlation expansion (CCE) method with parameters of the s…