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Title: Effects of Alkaline Earth Metal Additives on Methylammonium‐Free Lead Halide Perovskite Thin Films and Solar Cells
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NSF-PAR ID:
10369195
Author(s) / Creator(s):
 ;  ;  ;  ;  
Publisher / Repository:
Wiley Blackwell (John Wiley & Sons)
Date Published:
Journal Name:
Solar RRL
Volume:
6
Issue:
8
ISSN:
2367-198X
Format(s):
Medium: X
Sponsoring Org:
National Science Foundation
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  1. Abstract

    The two‐step conversion process consisting of metal halide deposition followed by conversion to hybrid perovskite has been successfully applied toward producing high‐quality solar cells of the archetypal MAPbI3hybrid perovskite, but the conversion of other halide perovskites, such as the lower bandgap FAPbI3, is more challenging and tends to be hampered by the formation of hexagonal nonperovskite polymorph of FAPbI3, requiring Cs addition and/or extensive thermal annealing. Here, an efficient room‐temperature conversion route of PbI2into the α‐FAPbI3perovskite phase without the use of cesium is demonstrated. Using in situ grazing incidence wide‐angle X‐ray scattering (GIWAXS) and quartz crystal microbalance with dissipation (QCM‐D), the conversion behaviors of the PbI2precursor from its different states are compared. α‐FAPbI3forms spontaneously and efficiently at room temperature from P2(ordered solvated polymorphs with DMF) without hexagonal phase formation and leads to complete conversion after thermal annealing. The average power conversion efficiency (PCE) of the fabricated solar cells is greatly improved from 16.0(±0.32)% (conversion from annealed PbI2) to 17.23(±0.28)% (from solvated PbI2) with a champion device PCE > 18% due to reduction of carrier recombination rate. This work provides new design rules toward the room‐temperature phase transformation and processing of hybrid perovskite films based on FA+cation without the need for Cs+or mixed halide formulation.

     
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  2. Abstract

    Hybrid organic inorganic perovskite solar cells based on CH3NH3PbI3have drastically increased in efficiency over the past several years and are competitive with decades‐old photovoltaic materials such as CdTe. Despite this impressive increase, significant issues still remain due to the intrinsic instability of CH3NH3PbI3which degrades into carcinogenic PbI2. Recently, double halide perovskites which use a pair of 1+–3+cations to replace Pb2+, such as Cs2InSbI6, and chalcogenide perovskites, such as BaZrS3, have been explored as potential replacements. In this work, double chalcogenide perovskites are explored to identify novel photovoltaic absorbers that can replace CH3NH3PbI3. Due to the large space of possible compounds, machine learning methods are used to classify materials as potential photovoltaic absorbers using data from the periodic table, eliminating wasteful computation. A random forest algorithm achieves a cross‐validation accuracy of 86.4% on the constructed data set. Over 450 possible replacements are identified via traditional and statistical methods with Ba2AlNbS6, Ba2GaNbS6, Ca2GaNbS6, Sr2InNbS6, and Ba2SnHfS6as the most promising alternative when thermodynamic stability, kinetic stability, and optical absorption are considered.

     
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