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cond-mat.mtrl-sci2025
Molecular Dynamics Simulations of Collision Cascades in Niobium: Comparing Interatomic Potentials
S. Mondal, U. Bhardwaj, A. Majalee +2
Radiation damage in structural materials is a major challenge for advanced nuclear energy systems, and niobium is of particular interest due to its high melting point, mechanical s…
cond-mat.mtrl-sci2025
A Robust Machine Learned Interatomic Potential for Nb: Collision Cascade Simulations with accurate Defect Configurations
Utkarsh Bhardwaj, Vinayak Mishra, Suman Mondal +1
Niobium (Nb) and its alloys are extensively used in various technological applications owing to their favorable mechanical, thermal and irradiation properties. Accurately modeling…