2 papers
cond-mat.mes-hall2026
Tuning the optoelectronic and magnetic properties of Penta-PtN2 nanoribbons via edge engineering and defects
Le Thi Thuy My, Pham Thi Bich Thao, Nguyen Hai Dang +1
In this study, we investigate aspects including the structural, electronic, optical, and magnetic properties of the PtN$\_\{2\}$ nanoribbons.
cond-mat.mtrl-sci2026
Efficient molecular dynamics simulation of 2D penta-silicene materials using machine learning potentials
Le Huu Nghia, Pham Thi Bich Thao, Truong Do Anh Kha +2
Machine Learning Interatomic Potentials (MLIPs) are a modern computational method that allows achieving near-quantum mechanical accuracy (DFT) while still describing large-scale sy…