2 papers
cond-mat.mtrl-sci2024
Structural, Electronic, and Li-ion Adsorption Properties of PolyPyGY Explored by First-Principles and Machine Learning Simulations: A New Multi-Ringed 2D Carbon Allotrope
K. A. L. Lima, D. A. da Silva, G. D. Amvame Nze +3
Two-dimensional (2D) carbon materials have been intensively investigated because of their distinctive structural framework and electronic behaviors as alternatives in energy conver…
cond-mat.mtrl-sci2023
TODD-Graphene: A Novel Porous 2D Carbon Allotrope for High-Performance Lithium-Ion Batteries
E. J. A. Santos, K. A. L. Lima, L. A. Ribeiro Junior
The class of 2D carbon allotropes has garnered significant attention due to its exceptional optoelectronic and mechanical properties, crucial for diverse device applications, such…