Yashar Yourdshahyan
Showing 9 publications
Surface properties of metastable alumina: A comparative study of κ- and α-Al2O3
Adiabatic potential-energy surfaces for oxygen on Al(111)
Density-functional bridge between surfaces and interfaces
Theoretical Structure Determination of a Complex Material: κ-Al2O3
Alumina (Al2O3) and Oxidation of Aluminium. A First-Principles Study
First-principles calculations on the atomic and electronic structure of kappa-Al2O3
Structure and energetics of kappa alumina (-Al2O3) calculated from first principles
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