(INVITED) Revisiting Duffy's model for Sb3+ and Bi3+ in double halide perovskites: Emergence of a descriptor for machine learning

The Duffy's model is reformulated for Sb3+ and Bi3+ in cubic chloro- and bromo-elpasolites with « 0D » perovskite structure. The new equation allows calculating the energy of the first s2 → s1p1 electron transition from crystal structure data. The Stokes shift pertaining to the Sb3+ emission in...

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Bibliographic Details
Main Author: Philippe Boutinaud
Format: Article
Language:English
Published: Elsevier 2021-08-01
Series:Optical Materials: X
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2590147821000127