| About this Abstract |
| Meeting |
2025 TMS Annual Meeting & Exhibition
|
| Symposium
|
Computational Thermodynamics and Kinetics
|
| Presentation Title |
Atomistic modeling insights in low energy implantation for high quality synthesis |
| Author(s) |
Eva Zarkadoula, Sumner Harris |
| On-Site Speaker (Planned) |
Eva Zarkadoula |
| Abstract Scope |
Synthesis processes involve complex mechanisms and physical or chemical pathways that depend on various parameters and conditions. Fundamental understanding of these mechanisms is crucial for refining the parameter space and establishing criteria for efficient synthesis of high-quality materials. In this talk, I will discuss atomistic modeling approaches aimed at uncovering the fundamental mechanisms underlying low-energy implantation processes for the synthesis of Janus monolayers, systems that exhibit enhanced properties relative to their transition metal dichalcogenides counterparts. By integrating simulations and experiments, we elucidate the pathways for synthesis of high-quality materials where damage minimization is essential for achieving high efficiency.
Work was supported by the Center for Nanophase Materials Sciences, a US Department of Energy, Office of Science User Facility at Oak Ridge National Laboratory. |
| Proceedings Inclusion? |
Planned: |
| Keywords |
Modeling and Simulation, Thin Films and Interfaces, |