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The OXIREC project aims to develop theoretical methods for predicting the structure of interfaces in complex oxide materials. Understanding these interfaces is crucial for enhancing the properties of functional oxide heterostructures.
One of the most challenging problems in material science is establishing a relation between material’s properties and interfacial structure.
The presence of interfaces may strongly affect the properties of most polycrystalline materials.
Interfaces play a determining role in properties of functional oxide heterostructures – artificial materials that attracted an increased attention over the past decade due to the wide range of properties they exhibit.
The ability to predict equilibrium atomistic…
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