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Ab initio investigation of structural, elastic, and thermodynamic characteristics of tetragonal XAgO compounds (X = Li, Na, K, Rb)
Allali, Djamel; Amari, Rabie; Bouhemadou, Abdelmadjid; Boukhari, Ammar; Deghfel, Bahri; Essaoud, Saber Saad; Bin-Omran, Saad; Radjai, Missoum; Khenata, Rabah; Al-Douri, Yarub (Institute of Physics, 2023)The present research utilizes ab initio computations to examine the thermodynamic, structural, and elastic characteristics of XAgO ternary oxides, where X signifies Li, Na, K, and Rb.The GGA-PBE and GGA-WC functionals were ...
