Computational identification of efficient 2D Aluminium chalcogenides monolayers for optoelectronics and photocatalysts applications
Zakaryae Haman, Nabil Khossossi, Moussa Kibbou, I. Bouziani, Deobrat Singh, I. Essaoudi, A. Ainane, Rajeev Ahuja
Topics & Concepts
Density functional theoryMonolayerBand gapAb initioMaterials scienceHybrid functionalChemical physicsChemistryGibbs free energyComputational chemistryOptoelectronicsNanotechnologyThermodynamicsOrganic chemistryPhysics2D Materials and ApplicationsChalcogenide Semiconductor Thin FilmsQuantum Dots Synthesis And Properties