Research Focus

My research bridges the gap between Reactive Molecular Dynamics (RMD) and Continuum Mechanics. I focus on computational modeling of fluid and thermal systems to enhance energy efficiency, reduce emissions, and promote sustainable technologies.

Soot
Soot Formation

Investigating the molecular dynamics of soot formation during combustion, focusing on the evolution of physicochemical properties using RMD simulations.

CFD
CFD Modeling

Applying high-fidelity simulations to model fluid dynamics and thermal systems, emphasizing optimized energy conversion processes.

Emissions
Emissions Reduction

Developing predictive models to reduce particulate emissions from combustion devices to enhance efficiency and minimize environmental impact.

HPC & Infrastructure
HPC & Infrastructure

Leveraging HPC environments for large-scale simulations. Expertise in Load Balancing, Docker, and Cluster Networking to support reproducible research.

Materials
Advanced Materials

Investigating the role of new materials in improving heat transfer, energy storage, and thermal management in industrial sectors.

ML
Machine Learning

Integrating ML techniques (e.g., SAGE) with computational models to automate analysis of molecular dynamics simulations and experimental data.


Formatted Publication List

Dynamically loaded from BibTeX

Khaled Mosharraf Mukut, Ph.D.
Postdoctoral Research Fellow | Marquette University

© Copyright 2026 - All Rights Reserved