One important foundation of the computational work is a long-standing investment into the creation of computational simulation codes for materials properties.
Perovskite materials are a class of compounds that have gained significant attention in the field of materials science due to their unique properties, particularly in the area of semiconductors. These materials, which are defined by their specific crystalline structure, can be used in applications likeThe paper focuses on refining the structural control of layered perovskite materials with organic semiconductor incorporation.