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Unraveling photoexcitation dynamics at "dots-in-a-perovskite" heterojunctions from first-principles

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成果类型:
期刊论文
作者:
Li, Wei;Zhang, Xu;Lu, Gang*
通讯作者:
Lu, Gang
作者机构:
[Li, Wei] Hunan Agr Univ, Coll Sci, Changsha 410128, Hunan, Peoples R China.
[Zhang, Xu; Lu, Gang] Calif State Univ Northridge, Dept Phys & Astron, Northridge, CA 91330 USA.
通讯机构:
[Lu, Gang] C
Calif State Univ Northridge, Dept Phys & Astron, Northridge, CA 91330 USA.
语种:
英文
期刊:
Journal of Materials Chemistry A
ISSN:
2050-7488
年:
2019
卷:
7
期:
30
页码:
18012-18019
基金类别:
We acknowledge the startup funding from Hunan Agricultural University (grant no. 540741800499 and 18QN02). The work at California State University Northridge was supported by the US National Science Foundation (DMR-1828019).
机构署名:
本校为第一机构
院系归属:
理学院
摘要:
Both organohalide perovskites and colloidal quantum dots are attractive and promising materials for optoelectronic applications. Recent experiments have combined the two to create "quantum dot-in-perovskite" assemblies for highly efficient light emissions. In this work, we unravel photoexcitation dynamics at the interface between the perovskite and the quantum dot by means of first-principles non-adiabatic molecular dynamics simulations. We find that such assemblies adopt the type-I band structure and are free of defect states. The interfacial ...

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