volume 64 issue 6 pages 702-707

Formability of ABX3 (X = F, Cl, Br, I) halide perovskites.

Publication typeJournal Article
Publication date2008-11-14
SJR
CiteScore
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ISSN01087681, 16005740
General Biochemistry, Genetics and Molecular Biology
General Medicine
Abstract

In this study a total of 186 complex halide systems were collected; the formabilities of ABX 3 (X = F, Cl, Br and I) halide perovskites were investigated using the empirical structure map, which was constructed by Goldschmidt's tolerance factor and the octahedral factor. A model for halide perovskite formability was built up. In this model obtained, for all 186 complex halides systems, only one system (CsF–MnF2) without perovskite structure and six systems (RbF–PbF2, CsF–BeF2, KCl–FeCl2, TlI–MnI2, RbI–SnI2, TlI–PbI2) with perovskite structure were wrongly classified, so its predicting accuracy reaches 96%. It is also indicated that both the tolerance factor and the octahedral factor are a necessary but not sufficient condition for ABX 3 halide perovskite formability, and a lowest limit of the octahedral factor exists for halide perovskite formation. This result is consistent with our previous report for ABO3 oxide perovskite, and may be helpful to design novel halide materials with the perovskite structure.

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GOST |
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GOST Copy
Li C. et al. Formability of ABX3 (X = F, Cl, Br, I) halide perovskites. // Acta Crystallographica Section B Structural Science. 2008. Vol. 64. No. 6. pp. 702-707.
GOST all authors (up to 50) Copy
Li C., Lu X., Ding W., Feng L., Gao Y., Guo Z. Formability of ABX3 (X = F, Cl, Br, I) halide perovskites. // Acta Crystallographica Section B Structural Science. 2008. Vol. 64. No. 6. pp. 702-707.
RIS |
Cite this
RIS Copy
TY - JOUR
DO - 10.1107/S0108768108032734
UR - https://doi.org/10.1107/S0108768108032734
TI - Formability of ABX3 (X = F, Cl, Br, I) halide perovskites.
T2 - Acta Crystallographica Section B Structural Science
AU - Li, Chonghea
AU - Lu, Xionggang
AU - Ding, Weizhong
AU - Feng, Liming
AU - Gao, Yonghui
AU - Guo, Ziming
PY - 2008
DA - 2008/11/14
PB - International Union of Crystallography (IUCr)
SP - 702-707
IS - 6
VL - 64
PMID - 19029699
SN - 0108-7681
SN - 1600-5740
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{2008_Li,
author = {Chonghea Li and Xionggang Lu and Weizhong Ding and Liming Feng and Yonghui Gao and Ziming Guo},
title = {Formability of ABX3 (X = F, Cl, Br, I) halide perovskites.},
journal = {Acta Crystallographica Section B Structural Science},
year = {2008},
volume = {64},
publisher = {International Union of Crystallography (IUCr)},
month = {nov},
url = {https://doi.org/10.1107/S0108768108032734},
number = {6},
pages = {702--707},
doi = {10.1107/S0108768108032734}
}
MLA
Cite this
MLA Copy
Li, Chonghea, et al. “Formability of ABX3 (X = F, Cl, Br, I) halide perovskites..” Acta Crystallographica Section B Structural Science, vol. 64, no. 6, Nov. 2008, pp. 702-707. https://doi.org/10.1107/S0108768108032734.