Structure and Properties of Functional Oxide Thin Films: Insights From Electronic‐Structure Calculations
Structure and Properties of Functional Oxide Thin Films: Insights From Electronic‐Structure Calculations
Abstract The confluence of state‐of‐the‐art electronic‐structure computations and modern synthetic materials growth techniques is proving indispensable in the search for and discovery of new functionalities in oxide thin films and heterostructures. Here, we review the recent contributions of electronic‐structure calculations to predicting, understanding, and discovering new materials physics in thin‐film …