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Category: Chemical Physics

Enhanced DFT predictions of the structural and optoelectronic properties of MoTe<sub>2</sub> for high performance photodetection: Application to GW-based functionals and Hubbard U and V corrections

Enhanced DFT predictions of the structural and optoelectronic properties of MoTe<sub>2</sub> for high performance photodetection: Application to GW-based functionals and Hubbard U and V corrections

Publication date: Available online 18 July 2023Source: Chemical PhysicsAuthor(s): Shehu Aminu Yamusa, Amiruddin Shaari, Norah A.M. Alsaif, Najeh Rekik, G. Lakshminarayana, Ibrahim Isah, Magaji Ismail, Razif Razali

Lead-free halide double perovskites Rb<sub>2</sub>InSbX<sub>6</sub> (X=F, Cl, Br, I): A first-principles study of structural and optoelectrical properties

Lead-free halide double perovskites Rb<sub>2</sub>InSbX<sub>6</sub> (X=F, Cl, Br, I): A first-principles study of structural and optoelectrical properties

Publication date: Available online 16 July 2023Source: Chemical PhysicsAuthor(s): Tianji Ou, Quan Zhuang, Huacai Yan, Shuang Feng, Peifang Li, Xinjun Ma