ﻻ يوجد ملخص باللغة العربية
MXenes, a family of two-dimensional transition metal carbides and nitrides, have various tunable physical and chemical properties. Their diverse prospective applications in electronics and energy storage devices have triggered great interests in science and technology. MXenes can be functionalized by different surface terminations. Some O and F functionalized MXenes monolayers have been predicted to be topological insulators (TIs). However, the reported OH functionalized MXenes TIs are very few and their electronic structures need to be investigated in more detail. It has been revealed that the work functions of MXenes are reduced significantly by OH termination and the image potential (IP) states move close to the Fermi level. The wave functions of these IP states are spatially extensive outside the surfaces. By stacking the OH-functionalized MXenes, the energies of the IP states can be modulated by the interlayer distances of multilayers, because the overlap and hybridization of the wave functions between the neighboring layers are significant. Therefore, these stacking layers are interacted and coupled with IP states. Here, based on first-principles calculations, we demonstrate that the stacking of two-dimensional topologically trivial OH-functionalized MXenes, such as V$_2$HfC$_2$(OH)$_2$, possibly gives rise to the topologically nontrivial energy bands. In other words, the topological properties of V$_2$HfC$_2$(OH)$_2$ multilayers can be modulated by its interlayer distance. An energy band inversion involving IP states is proposed. We expect that these results can advance the future application of MXenes or other low work function multilayer materials as controllable TI devices.
The transition from topologically nontrivial to a trivial state is studied by first-principles calculations on bulk zinc-blende type (Hg$_{1-x}$Zn$_x$)(Te$_{1-x}$S$_x$) disordered alloy series. The random chemical disorder was treated by means of the
We study the magnetic proximity effect on a two-dimensional topological insulator in a CrI$_3$/SnI$_3$/CrI$_3$ trilayer structure. From first-principles calculations, the BiI$_3$-type SnI$_3$ monolayer without spin-orbit coupling has Dirac cones at t
The interplay between various symmetries and electronic bands topology is one of the core issues for topological quantum materials. Spontaneous magnetism, which leads to the breaking of time-reversal symmetry, has been proven to be a powerful approac
Recent progress in understanding the electronic band topology and emergent topological properties encourage us to reconsider the band structure of well-known materials including elemental substances. Controlling such a band topology by external field
We report a direct observation of temperature-induced topological phase transition between trivial and topological insulator in HgTe quantum well. By using a gated Hall bar device, we measure and represent Landau levels in fan charts at different tem