Unravelling the environmental degradation mechanism of perovskite thin films

Despite having remarkable efficiency, solar cells made of metal halide perovskites - such as methylammonium lead iodide (MAPbI3) - are detrimental because of their innate instability. Since the precursor materials may have an impact on the degradation of MAPbI3, the degradation needs to be studied a...

Teljes leírás

Elmentve itt :
Bibliográfiai részletek
Szerzők: Nalini V
Nagy Gergely Norbert
Rahaman Ariful
Kalpathy Sreeram K.
Thomas Tiju
Sumangala T. P.
Upadhyay Kahaly Mousumi
Dokumentumtípus: Cikk
Megjelent: 2024
Sorozat:MATERIALS ADVANCES 5 No. 16
Tárgyszavak:
doi:10.1039/d4ma00574k

mtmt:35160918
Online Access:http://publicatio.bibl.u-szeged.hu/36618
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520 3 |a Despite having remarkable efficiency, solar cells made of metal halide perovskites - such as methylammonium lead iodide (MAPbI3) - are detrimental because of their innate instability. Since the precursor materials may have an impact on the degradation of MAPbI3, the degradation needs to be studied at the precursor level. If they are not chemically stable or contain components that are prone to degradation, these effects can be felt on the resulting perovskite. For comprehending the degradation cycle, aging studies were conducted on precursors - methylammonium iodide (MAI) and lead iodide (PbI2) powders, as well as on MAPbI3 thin films. We perform aging studies starting from freshly synthesized samples over a span of 60 days on the precursors and over a span of 21 days on MAPbI3 thin films. The degradation pathways of the precursors and MAPbI3 are characterized by utilizing X-ray diffraction (XRD), FTIR spectroscopy, UV-Vis-NIR spectroscopy and field emission scanning electron microscopy (FESEM). The aging studies reveal that the synthesized organic precursors are unstable under ambient conditions and that the hybridized valence states of MAPbI3 exhibit higher sensitivity under ambient conditions compared to that of their precursors. The material is observed to decompose into PbI2 over the span of 21 days. We find that the structure of the MAI precursor degrades over time due to photooxidation-induced disintegration of the organic compound, while the PbI2 precursor undergoes agglomeration while the structure is preserved. We explore the origin of the observed degradation and identify that the hybridized orbitals between MAI and PbI2 initiate a sequence of chemical reactions responsible for this instability. Through ab initio simulations, we identify H2O as the atmospheric molecule most readily incorporated in MAPbI3, and this effect is corroborated by experimental observation of water-related degradation in the samples. On the other hand, incorporation of O2 is shown to cause the most significant change to the electronic structure. The susceptibility of these perovskites toward various atmospheric molecules under ambient conditions emphasizes its critical role in the perovskite's structural distortion and subsequent chemical alterations. 
650 4 |a Fizikai tudományok 
700 0 1 |a Nagy Gergely Norbert  |e aut 
700 0 1 |a Rahaman Ariful  |e aut 
700 0 1 |a Kalpathy Sreeram K.  |e aut 
700 0 1 |a Thomas Tiju  |e aut 
700 0 1 |a Sumangala T. P.  |e aut 
700 0 2 |a Upadhyay Kahaly Mousumi  |e aut 
856 4 0 |u http://publicatio.bibl.u-szeged.hu/36618/1/35160918.pdf  |z Dokumentum-elérés