Prof.
Francisco B. C. Machado
(Instituto Tecnológico de Aeronáutica)
16/09/2022 10:10
Abstract
The n-acenes are a class of polyaromatic hydrocarbons (PAHs) composed of linearly condensed benzene rings, resembling a quasi-1D graphene strip with zigzag boundaries. The two-dimensional structures are known as periacenes. The acenes with more than five linear benzene rings, are characterized by having a singlet open shell wave function in the ground state, showing that these...
