Development of the ReaxFF Reactive Force Field for Li/Mn/O Battery Technology with Application to Design a Self-Healing Cathode Electrolyte Interphase

MK Talkhoncheh, H Ghods… - The Journal of …, 2024 - ACS Publications
Lithium manganese oxide (LMO) batteries, notable for their three-dimensional structure
enhancing ion transport and power, are ideal for critical uses, such as implantable …

Optimization of ReaxFF reactive force field parameters for Cu/Si/O systems via neural network inversion with application to copper oxide interaction with silicon

KA Roshan, MK Talkhoncheh, MY Sengul… - The Journal of …, 2023 - ACS Publications
The presence of transition metal oxide impurities introduced during crystal formation or
during the fabrication process may lead to a significant yield loss in microelectronics and …

[HTML][HTML] An Arrhenius-Based Simulation Tool for Predicting Aging of Lithium Manganese Dioxide Primary Batteries in Implantable Medical Devices

M Doosthosseini, M Khajeh Talkhoncheh… - Energies, 2024 - mdpi.com
This article presents a novel aging-coupled predictive thermo-electrical dynamic modeling
tool tailored for primary lithium manganese dioxide (L iM n O 2) batteries in active …

Investigating Surface Reactivity and Degradation Mechanisms of Electrode Materials Through the Evolution of Heat Dissipation

MN Vila - 2023 - search.proquest.com
Advances in understanding electrode materials are integral for the commercialization of
renewable, cost-effective, and efficient energy storage devices. Development of battery …