Ab initio exploration of A2AlAgCl6 (A = Rb, Cs): unveiling potentials for UV optoelectronic applications
T. Lantri, Abdelkader Mostefa, M. Houari, S. Mesbah, Slimane Haid, Y. Guermit, B. Bouadjemi, M. Matougui, S. Bentata
Topics & Concepts
Ab initioAb initio quantum chemistry methodsMaterials scienceComputational chemistryPhysicsOptoelectronicsAtomic physicsChemistryQuantum mechanicsMoleculePerovskite Materials and ApplicationsOptical properties and cooling technologies in crystalline materialsSolid-state spectroscopy and crystallography