Probing the structural, mechanical, phonon, thermal, and transport properties of magnetic halide perovskites XTiBr3 (X = Rb, Cs) through ab-initio results

Abstract Herein, we have first reported the intrinsic properties, including structural, mechanical, electronic, magnetic, thermal, and transport properties of XTiBr3 (X = Rb, Cs) halide perovskites within the simulation scheme of density functional theory as integrated into Wien2k. First and foremos...

وصف كامل

التفاصيل البيبلوغرافية
المؤلفون الرئيسيون: Vishal Shivhare, Saveer Ahmad Khandy, Dinesh C. Gupta
التنسيق: مقال
اللغة:English
منشور في: Nature Portfolio 2023-06-01
سلاسل:Scientific Reports
الوصول للمادة أونلاين:https://doi.org/10.1038/s41598-023-34047-5