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Harikrishnan Kumarasamy

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Open access Oct 2026

ATOMISTIC MOLECULAR DYNAMICS SIMULATION OF CU THIN-FILM GROWTH UNDER MOLECULAR BEAM EPITAXY CONDITIONS: EFFECTS OF SUBSTRATE TEMPERATURE AND INCIDENT KINETIC ENERGY

A molecular dynamics framework was developed to examine the combined influence of substrate temperature and incident kinetic energy on Cu-on-Cu(001) thin-film growth under molecular beam epitaxy (MBE) conditions. The simulations solve Newton's equations of motion using the Mishin embedded-atom method (EAM) potential fo...

Harikrishnan Kumarasamy · 0 citations
Open access Sep 2026

AI/ML-Assisted Inverse Alloy Design of Multi-Principal Element Alloys for High-Temperature Energy Systems: Comparative Tree Ensembles and Deep Neural-Network Surrogates

AI/ML is positioned not as a replacement for experiment, but as a transparent decision-support layer for narrowing high-dimensional alloy spaces and prioritising candidates for experimental validation in high-temperature energy applications.

Harikrishnan Kumarasamy · 0 citations

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