Revealing unusual bandgap shifts with temperature and bandgap renormalization effect in phase-stabilized metal halide perovskite thin films

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Hauptverfasser: Zhang, Haochen, Bi, Zhixuan, Zhai, Zehua, Gao, Han, Liu, Yuwei, Jin, Meiling, Ye, Meng, Li, Xuanzhang, Liu, Haowen, Zhang, Yuegang, Li, Xiang, Tan, Hairen, Xu, Yong, Yang, Luyi
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Veröffentlicht: 2023
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author Zhang, Haochen
Bi, Zhixuan
Zhai, Zehua
Gao, Han
Liu, Yuwei
Jin, Meiling
Ye, Meng
Li, Xuanzhang
Liu, Haowen
Zhang, Yuegang
Li, Xiang
Tan, Hairen
Xu, Yong
Yang, Luyi
author_facet Zhang, Haochen
Bi, Zhixuan
Zhai, Zehua
Gao, Han
Liu, Yuwei
Jin, Meiling
Ye, Meng
Li, Xuanzhang
Liu, Haowen
Zhang, Yuegang
Li, Xiang
Tan, Hairen
Xu, Yong
Yang, Luyi
contents Hybrid organic-inorganic metal halide perovskites are emerging materials in photovoltaics, whose bandgap is one of the most crucial parameters governing their light harvesting performance. Here we present the temperature and photocarrier density dependence of the bandgap in two phase-stabilized perovskite thin films (MA0.3FA0.7PbI3 and MA0.3FA0.7Pb0.5Sn0.5I3) using photoluminescence and absorption spectroscopy. Contrasting bandgap shifts with temperature are observed between the two perovskites. Using X-ray diffraction and in situ high-pressure photoluminescence spectroscopy, we show that thermal expansion plays only a minor role in the large bandgap blueshift, which is attributed to the enhanced structural stability of our samples. Our first-principles calculations further demonstrate the significant impact of thermally induced lattice distortions on the bandgap widening. We propose that the anomalous trends are caused by the competition between static and dynamic distortions. Additionally, both the bandgap renormalization and band filling effects are directly observed for the first time in fluence-dependent photoluminescence measurements and are employed to estimate the exciton effective mass. Our results provide new insights into the basic understanding of thermal and charge-accumulation effects on the band structure of hybrid perovskite thin films.
format Preprint
id arxiv_https___arxiv_org_abs_2308_11104
institution arXiv
publishDate 2023
record_format arxiv
spellingShingle Revealing unusual bandgap shifts with temperature and bandgap renormalization effect in phase-stabilized metal halide perovskite thin films
Zhang, Haochen
Bi, Zhixuan
Zhai, Zehua
Gao, Han
Liu, Yuwei
Jin, Meiling
Ye, Meng
Li, Xuanzhang
Liu, Haowen
Zhang, Yuegang
Li, Xiang
Tan, Hairen
Xu, Yong
Yang, Luyi
Materials Science
Hybrid organic-inorganic metal halide perovskites are emerging materials in photovoltaics, whose bandgap is one of the most crucial parameters governing their light harvesting performance. Here we present the temperature and photocarrier density dependence of the bandgap in two phase-stabilized perovskite thin films (MA0.3FA0.7PbI3 and MA0.3FA0.7Pb0.5Sn0.5I3) using photoluminescence and absorption spectroscopy. Contrasting bandgap shifts with temperature are observed between the two perovskites. Using X-ray diffraction and in situ high-pressure photoluminescence spectroscopy, we show that thermal expansion plays only a minor role in the large bandgap blueshift, which is attributed to the enhanced structural stability of our samples. Our first-principles calculations further demonstrate the significant impact of thermally induced lattice distortions on the bandgap widening. We propose that the anomalous trends are caused by the competition between static and dynamic distortions. Additionally, both the bandgap renormalization and band filling effects are directly observed for the first time in fluence-dependent photoluminescence measurements and are employed to estimate the exciton effective mass. Our results provide new insights into the basic understanding of thermal and charge-accumulation effects on the band structure of hybrid perovskite thin films.
title Revealing unusual bandgap shifts with temperature and bandgap renormalization effect in phase-stabilized metal halide perovskite thin films
topic Materials Science
url https://arxiv.org/abs/2308.11104