Comment on "Study of perovskite JDCl3 (J = Fr, and D = Ca, Sr, Ge, Sn) materials for smart window and optoelectronic applications: A computational predictions” J. Phys. Chem. Solids 205 (2025) 112771

IF 4.3 3区材料科学 Q2 CHEMISTRY, MULTIDISCIPLINARY

Journal of Physics and Chemistry of Solids Pub Date : 2025-05-28 DOI:10.1016/j.jpcs.2025.112900

Michal J. Winiarski

引用次数: 0

Abstract

In their recent article Shoukat Hussain et al. ¹ report the results of their density functional theory (DFT) calculations on a series of four Francium-bearing cubic perovskite materials FrDCl₃ (D = Ca, Sr, Ge, Sn), discussing their possible applications for smart windows and optoelectronics. In this comment, I highlight the issue of Fr instability that completely undermines the applicability of any Fr-based materials.

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钙钛矿JDCl3 （J = Fr, and D = Ca, Sr, Ge, Sn）材料在智能窗口和光电子应用中的研究：计算预测[J]。化学。固体205 (2025)112771

在他们最近的一篇文章中，Shoukat Hussain等人报告了他们对一系列四种含钫立方钙钛矿材料FrDCl3 （D = Ca, Sr, Ge, Sn）的密度泛函理论（DFT）计算结果，讨论了它们在智能窗口和光电子方面的可能应用。在这篇评论中，我强调了Fr不稳定性的问题，它完全破坏了任何Fr基材料的适用性。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

Journal of Physics and Chemistry of Solids 工程技术-化学综合

CiteScore

7.80

自引率

2.50%

发文量

605

审稿时长

40 days

期刊介绍： The Journal of Physics and Chemistry of Solids is a well-established international medium for publication of archival research in condensed matter and materials sciences. Areas of interest broadly include experimental and theoretical research on electronic, magnetic, spectroscopic and structural properties as well as the statistical mechanics and thermodynamics of materials. The focus is on gaining physical and chemical insight into the properties and potential applications of condensed matter systems. Within the broad scope of the journal, beyond regular contributions, the editors have identified submissions in the following areas of physics and chemistry of solids to be of special current interest to the journal: Low-dimensional systems Exotic states of quantum electron matter including topological phases Energy conversion and storage Interfaces, nanoparticles and catalysts.