3 papers
cond-mat.mtrl-sci2025
Atomistic Simulations of Short-range Ordering with Light Interstitials in Inconel Superalloys
Tyler D. Dolžal, Emre Tekoglu, Jong-Soo Bae +3
This study employed hybrid Monte Carlo Molecular Dynamics simulations to investigate the short-range ordering behavior of Ni-based superalloys doped with boron or carbon. The simul…
cond-mat.mtrl-sci2025
Segregation and Ordering of Light Interstitials (B, C, H, and N) in Cr-Ni Alloys: Implications for Grain Boundary Stability in Superalloy Design
Tyler D. Doležal, Rodrigo Freitas, Ju Li
The segregation and ordering behavior of light interstitials (B, C, and N) in Cr30-Ni is examined, as these elements are critical for grain boundary stability and high-temperature…
cond-mat.mtrl-sci2025
Machine learning potentials for modeling alloys across compositions
Killian Sheriff, Daniel Xiao, Yifan Cao +2
Materials properties depend strongly on chemical composition, i.e., the relative amounts of each chemical element. Changes in composition lead to entirely different chemical arrang…