3 papers
cond-mat.mtrl-sci2026
GRAINSMITH: A Generator of Polycrystalline Models for Atomistic Simulations with Statistical and Grain-Boundary Morphology Control
Oguzhan Orhan, Soner Özgen
Atomistic studies of grain-boundary engineering, grain-size effects and dopant enrichment require reproducible models with prescribed microstructural features. We present GRAINSMIT…
physics.chem-ph2026
Low-Temperature Transport in Li-Ion Battery EC/EMC/FEC Electrolytes: Molecular Dynamics and Machine-Learning Modeling
İpek Yenda Çınar, Oguzhan Orhan, M. Oluş Özbek +1
Low-temperature operation imposes severe limitations on lithium-ion transport in battery electrolytes, yet the coupled effects of solvent composition and fluorinated additives in t…
cond-mat.mtrl-sci2023
Electronic Phase Transformations and Energy Gap Variations in Uniaxial and Biaxial Strained Monolayer VS TMDs: A Comprehensive DFT and Beyond-DFT Study
Oguzhan Orhan, Şener Özönder, Soner Ozgen
In the field of 2D materials, transition metal dichalcogenides (TMDs) are gaining attention for electronic applications. Our study delves into the H-phase monolayer VS of the T…