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, Georges Daniel Amvame Nze, Fábio Lúcio Lópes de Mendonça, Marcelo Lopes Pereira, Luiz Antônio Ribeiro