Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells

To promote the performance of perovskite solar cells (PSCs), its theoretical power conversion efficiency (PCE) and high stability, elaborative defect passivation, and interfacial engineering at the molecular level are required to regulate the optoelectric properties and charge transporting process a...

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Main Authors: He Xi, Zhicheng Song, Yonggang Guo, Weijia Zhu, Lisong Ding, Weidong Zhu, Dazheng Chen, Chunfu Zhang
Format: Article
Language:English
Published: MDPI AG 2022-07-01
Series:Polymers
Subjects:
Online Access:https://www.mdpi.com/2073-4360/14/13/2748
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author He Xi
Zhicheng Song
Yonggang Guo
Weijia Zhu
Lisong Ding
Weidong Zhu
Dazheng Chen
Chunfu Zhang
author_facet He Xi
Zhicheng Song
Yonggang Guo
Weijia Zhu
Lisong Ding
Weidong Zhu
Dazheng Chen
Chunfu Zhang
author_sort He Xi
collection DOAJ
description To promote the performance of perovskite solar cells (PSCs), its theoretical power conversion efficiency (PCE) and high stability, elaborative defect passivation, and interfacial engineering at the molecular level are required to regulate the optoelectric properties and charge transporting process at the perovskite/hole transport layer (HTL) interfaces. Herein, we introduce for the first time a multifunctional dipole polymer poly(2-ethyl-2-oxazoline) (PEOz) between the perovskite and Spiro-OMeTAD HTL in planar n-i-p PSCs, which advances the PSCs toward both high efficiency and excellent stability by stimulating three beneficial effects. First, the ether–oxygen unshared electron pairs in PEOz chemically react with unsaturated Pb<sup>2+</sup> on the perovskite surfaces by forming a strong Pb–O bond, which effectively reduces the uncoordinated defects on the perovskite surfaces and enhances the absorption ability of the resulting PSCs. Second, the dipole induced by PEOz at the perovskite/HTL interface can decrease the HOMO and LUMO level of Spiro-OMeTAD and optimize the band alignment between these layers, thereby suppressing the interfacial recombination and accelerating the hole transport/extraction ability in the cell. Third, the hygroscopic PEOz thin film can protect perovskite film from water erosion by absorbing the water molecules before perovskite does. Finally, the PEOz-modified PSC exhibits an optimized PCE of 21.86%, with a high short-circuit current density (Jsc) of 24.88 mA/cm<sup>2</sup>, a fill factor (FF) of 0.79, and an open-circuit voltage (Voc) of 1.11 V. The unencapsulated devices also deliver excellent operation stability over 300 h in an ambient atmosphere with a humidity of 30~40% and more than 10 h under thermal stress.
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spelling doaj.art-98b6596c44da45aeb2b6093cfb6d8e662023-12-01T21:39:58ZengMDPI AGPolymers2073-43602022-07-011413274810.3390/polym14132748Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar CellsHe Xi0Zhicheng Song1Yonggang Guo2Weijia Zhu3Lisong Ding4Weidong Zhu5Dazheng Chen6Chunfu Zhang7School of Advanced Materials and Nanotechnology, Xidian University, Xi’an 710126, ChinaState Key Discipline Laboratory of Wide Band Gap Semiconductor, School of Microelectronics, Xidian University, Xi’an 710071, ChinaQinghai Huanghe Hydropower Development Co., Ltd., Xi’an Solar Power Branch, Xi’an 710000, ChinaSchool of Advanced Materials and Nanotechnology, Xidian University, Xi’an 710126, ChinaSchool of Advanced Materials and Nanotechnology, Xidian University, Xi’an 710126, ChinaState Key Discipline Laboratory of Wide Band Gap Semiconductor, School of Microelectronics, Xidian University, Xi’an 710071, ChinaState Key Discipline Laboratory of Wide Band Gap Semiconductor, School of Microelectronics, Xidian University, Xi’an 710071, ChinaState Key Discipline Laboratory of Wide Band Gap Semiconductor, School of Microelectronics, Xidian University, Xi’an 710071, ChinaTo promote the performance of perovskite solar cells (PSCs), its theoretical power conversion efficiency (PCE) and high stability, elaborative defect passivation, and interfacial engineering at the molecular level are required to regulate the optoelectric properties and charge transporting process at the perovskite/hole transport layer (HTL) interfaces. Herein, we introduce for the first time a multifunctional dipole polymer poly(2-ethyl-2-oxazoline) (PEOz) between the perovskite and Spiro-OMeTAD HTL in planar n-i-p PSCs, which advances the PSCs toward both high efficiency and excellent stability by stimulating three beneficial effects. First, the ether–oxygen unshared electron pairs in PEOz chemically react with unsaturated Pb<sup>2+</sup> on the perovskite surfaces by forming a strong Pb–O bond, which effectively reduces the uncoordinated defects on the perovskite surfaces and enhances the absorption ability of the resulting PSCs. Second, the dipole induced by PEOz at the perovskite/HTL interface can decrease the HOMO and LUMO level of Spiro-OMeTAD and optimize the band alignment between these layers, thereby suppressing the interfacial recombination and accelerating the hole transport/extraction ability in the cell. Third, the hygroscopic PEOz thin film can protect perovskite film from water erosion by absorbing the water molecules before perovskite does. Finally, the PEOz-modified PSC exhibits an optimized PCE of 21.86%, with a high short-circuit current density (Jsc) of 24.88 mA/cm<sup>2</sup>, a fill factor (FF) of 0.79, and an open-circuit voltage (Voc) of 1.11 V. The unencapsulated devices also deliver excellent operation stability over 300 h in an ambient atmosphere with a humidity of 30~40% and more than 10 h under thermal stress.https://www.mdpi.com/2073-4360/14/13/2748perovskite solar celldipole polymerPEOzhygroscopicinterfacial engineering
spellingShingle He Xi
Zhicheng Song
Yonggang Guo
Weijia Zhu
Lisong Ding
Weidong Zhu
Dazheng Chen
Chunfu Zhang
Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
Polymers
perovskite solar cell
dipole polymer
PEOz
hygroscopic
interfacial engineering
title Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
title_full Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
title_fullStr Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
title_full_unstemmed Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
title_short Interfacial Dipole poly(2-ethyl-2-oxazoline) Modification Triggers Simultaneous Band Alignment and Passivation for Air-Stable Perovskite Solar Cells
title_sort interfacial dipole poly 2 ethyl 2 oxazoline modification triggers simultaneous band alignment and passivation for air stable perovskite solar cells
topic perovskite solar cell
dipole polymer
PEOz
hygroscopic
interfacial engineering
url https://www.mdpi.com/2073-4360/14/13/2748
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