Discovery of new crystal structures of iodide perovskites CsPbI <sub>3</sub> and RbPbI <sub>3</sub> using density functional theory

Iodine-based lead halide perovskites exhibit numerous potential phase transition structures that are challenging to identify experimentally.

Institutions

Publication Details

Journal
New Journal of Chemistry
Published
2025-01-01
DOI
https://doi.org/10.1039/d5nj01515d
Primary Topic
Perovskite Materials and Applications
Type
article
Field-Weighted Citation Impact
0.00
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article

Discovery of new crystal structures of iodide perovskites CsPbI 3 and RbPbI 3 using density functional theory

New Journal of Chemistry
Perovskite Materials and Applications
article

Discovery of new crystal structures of iodide perovskites CsPbI 3 and RbPbI 3 using density functional theory

article en

Abstract

Iodine-based lead halide perovskites exhibit numerous potential phase transition structures that are challenging to identify experimentally.

New Journal of ChemistryVol. 49(19)
Shanghai University (CN), Shanghai Research Institute of Materials (CN), China Construction Eighth Engineering Division (China) (CN)
Openalex Percentile: Top 58%
Perovskite Materials and Applications
DOISourceOpenAlex
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Discovery of new crystal structures of iodide perovskites CsPbI <sub>3</sub> and RbPbI <sub>3</sub> using density functional theory · New Journal of Chemistry (2025) | TGRS Research Map | TGRS