Fig. 3: AIMD studies of thermal energy on β-ETP2SbCl5.
From: Recyclable luminescent solar concentrator from lead-free perovskite derivative
a Crystal structures and the distributions of CBM at 298, 1500 K, and after quenching to 298 K; b MSD and c Sb-Cl RDF profiles of β-ETP2SbCl5 at 150, 298, 500, 1000, and 1500 K within 5 ps; d Simulated evolution of the [SbCl5] pyramid at 0, 150, 298, 500, 1000, 1500, 2000 K, and after quenching to 298 K. The focused Cl is labeled by a star for trace; e The concluded energy band structures for β- and G-ETP2SbCl5; f PL spectra of G-ETP2SbCl5 excited at 320, 350, 380, 400, and 420 nm
