A Topological\-Geometrical Descriptor (TGD) for Scalable and Interpretable Modeling of Two\-Dimensional Carbon Networks

Rômulo Uriel Liberal de Oliveira, Raphael Matozo Tromer

We introduce a compact Topological-Geometrical Descriptor (TGD) for planar two-dimensional carbon networks. Atomic coordinates are mapped to a periodic planar graph and represented…