CrossRef Open Access 2021 14 sitasi

Isosymmetric compression of cubic halide perovskites $$\mathrm{ABX}_{3}$$ ($$A=K, Rb, Cs$$; $$B=Ge, Sn, Pb$$ and $$X=Cl,Br,I$$)-influence of cation–anion exchange: a first principle study

Aneer Lamichhane N. M. Ravindra

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Abstrak

AbstractHalide perovskites are potential candidates for their use in solar cells. In this study, an investigation of the structural, mechanical and electro-optical properties of $$\mathrm{ABX}_{3}$$ ABX 3 ($$A=K, Rb, Cs$$ A = K , R b , C s ; $$B=Ge, Sn, Pb$$ B = G e , S n , P b and $$X=Cl,Br,I$$ X = C l , B r , I ), under isosymmetric compression, is presented. All the calculations are performed with generalized gradient approximation schemes. We have examined the effect of cation and anion substitution on their overall properties.

Penulis (2)

Aneer Lamichhane

N. M. Ravindra

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Lamichhane, A., Ravindra, N.M. (2021). Isosymmetric compression of cubic halide perovskites $$\mathrm{ABX}_{3}$$ ($$A=K, Rb, Cs$$; $$B=Ge, Sn, Pb$$ and $$X=Cl,Br,I$$)-influence of cation–anion exchange: a first principle study. https://doi.org/10.1007/s42452-020-04059-1

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Lihat di Sumber doi.org/10.1007/s42452-020-04059-1

Informasi Jurnal

Tahun Terbit: 2021
Bahasa: en
Total Sitasi: 14×
Sumber Database: CrossRef
DOI: 10.1007/s42452-020-04059-1
Akses: Open Access ✓