Instituto de Física, Universidade Federal de Uberlândia, C.P. 593, 38400-902, Uberlândia, MG, Brazil.
Phys Chem Chem Phys. 2019 Oct 28;21(40):22344-22350. doi: 10.1039/c9cp04760c. Epub 2019 Oct 2.
Materials with properties designed on-demand arise in a synergy between theoretical and experimental approaches. Here, we explore a set of Archimedean lattices, providing a guide to their electronic properties and topological phases. Within these lattices, a rich electronic structure emerges forming type-I and II Dirac fermions, topological flat bands and high-degeneracy points with linear and flat dispersions. Employing a tight-binding model with spin-orbit coupling, we characterize quantum spin Hall (QSH) phases in all Archimedean lattices. Our discussions are validated within density functional theory calculations, where we show the characteristic bands of the studied lattices arising in 2D carbon allotropes.
具有按需设计特性的材料是理论和实验方法协同作用的结果。在这里,我们探索了一组阿基米德格子,为它们的电子性质和拓扑相提供了指导。在这些格子中,出现了丰富的电子结构,形成了一类和二类狄拉克费米子、拓扑平带和具有线性和平坦色散的高简并点。我们采用带有自旋轨道耦合的紧束缚模型,对所有阿基米德格子中的量子自旋霍尔(QSH)相进行了表征。我们的讨论在密度泛函理论计算中得到了验证,其中我们展示了在二维碳同素异形体中出现的所研究格子的特征能带。