Li-Xian Yang

Unraveling Site‐Occupancy Mechanisms, Stability, and Mechanical Properties of Fe/Cr/V‐Doped Orthorhombic Cmcm‐Al6Mn Intermetallic: A First‐Principles Study

As a pivotal secondary phase governing microstructure evolution and mechanical performance of Al–Mn wrought alloys, Al6Mn intermetallic is constrained by its intrinsic brittleness, which impedes further property improvement of the alloy system. First‐principles calculations within the density functional theory framewor...