Lv41
490 积分 2026-03-23 加入
Electronic Structure of (Organic‐)Inorganic Metal Halide Perovskites: The Dilemma of Choosing the Right Functional
17分钟前
待确认
Cubic or Orthorhombic? Revealing the Crystal Structure of Metastable Black-phase CsPbI3 by Theory and Experiment
45分钟前
待确认
Disorder on Mixed Cation Halide Perovskite for Photovoltaic Applications
24天前
已完结
A comprehensive theoretical study of halide perovskites ABX3
26天前
已完结
Improving Phase Stability of α-CsPbI3 through Combined Strain-Doping Engineering: Insights from First-Principles Calculations and Machine Learning
26天前
已完结
Revealing the influence of doping elements (Ge, Sn, Ca, and Sr) on the properties of α-CsPbI3: a DFT investigation
26天前
已完结
Revealing the influence of B-site doping on the physical properties of CsPbI3: A DFT investigation
26天前
已完结
Phase transitions, phonon behavior and elastic constants in CsPbX3 (X = Br, Cl) single crystals: Experimental and theoretical insights
3个月前
已完结
Photovoltaic and related properties of Sn-doped disordered CsPb<sub>x</sub>Sn<sub>1−x</sub>Br<sub>3</sub> perovskite: a first-principles calculation
4个月前
已完结
Density functional study of structural, electronic and optical properties of bromine-doped CsPbI3 with the tetragonal symmetry
4个月前
已完结
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