
The Journal of Physical Chemistry C, Journal Year: 2024, Volume and Issue: unknown
Published: Sept. 26, 2024
Language: Английский
The Journal of Physical Chemistry C, Journal Year: 2024, Volume and Issue: unknown
Published: Sept. 26, 2024
Language: Английский
The Journal of Physical Chemistry Letters, Journal Year: 2024, Volume and Issue: 15(30), P. 7659 - 7666
Published: July 22, 2024
Sn-based perovskites with different cations in the A-site exhibit distinct electronic structures and dynamic properties. By utilizing time-dependent density functional theory nonadiabatic molecular dynamics, we demonstrate that larger FA decrease wave function overlap between initial final states slow down nuclear motion. In case of FASnI3, this alteration decreases coupling increases nonradiative electron-hole recombination time by 130% 76%, respectively, compared to CsSnI3 MASnI3 (CH3NH3SnI3). Furthermore, modification significantly improves electron mobility changes properties defects FASnI3 (HC(NH2)2SnI3), which achieves higher through a polar optical phonon-dominated scattering mechanism exhibits defect formation energy migration barriers due increased steric hindrance, relative MASnI3. These results emphasize critical cation substitution controlling mobility, characteristics provide theoretical insights for advancement novel lead-free perovskite materials.
Language: Английский
Citations
2Advanced Energy Materials, Journal Year: 2024, Volume and Issue: unknown
Published: Sept. 23, 2024
Abstract Intensity‐modulated photocurrent and photovoltage spectroscopy (IMPS/IMVS) are powerful tools in optoelectronics such as photoelectrochemistry photovoltaics, they demonstrate distinct charge dynamic processes at different frequencies. Unlike the material characterization techniques, IMPS/IMVS offer an approach for investigating behavior of carriers ions from device perspective. This review examines both theories experiments to understand intricate dynamics solar cells with various materials structures. To accommodate types cells, four primary theoretical models including rate constant model, drift‐diffusion equivalent circuit distribution relaxation times, evaluated detail. In future, incorporation other time‐domain frequency‐domain methods, along imaging can significantly facilitate enhanced convenience, spatial dimensions, accuracy.
Language: Английский
Citations
2Nano Energy, Journal Year: 2024, Volume and Issue: 133, P. 110473 - 110473
Published: Nov. 13, 2024
Language: Английский
Citations
1Published: Jan. 1, 2024
Language: Английский
Citations
0The Journal of Physical Chemistry C, Journal Year: 2024, Volume and Issue: unknown
Published: Sept. 26, 2024
Language: Английский
Citations
0