相关论文: Topological Semimetals Predicted from First-princi…
Nontrivial topology of Dirac (DSMs), Weyl (WSMs) and nodal line semimetals (NLSMs) are delineated by the novel band crossings near the Fermi level in the bulk and the appearance of exotic surface states. Among them, nodal line semimetals…
Semimetals, in which conduction and valence bands touch but do not form Fermi surfaces, have attracted considerable interest for their anomalous properties starting with the discovery of Dirac matter in graphene and other two-dimensional…
Weak topological insulators and Dirac semimetals are gapped and nodal phases with distinct topological properties, respectively. Here, we propose a novel topological phase that exhibits features of both and is dubbed composite Dirac…
Topological materials in crystal solids, including topological insulators (TIs), topological crystalline insulators (TCIs), topological Dirac semimetals (DSMs), topological Weyl semimetals (WSMs), topological Dirac or Weyl nodal line…
Recently, the Dirac and Weyl semimetals have attracted extensive attention in condensed matter physics due to both the fundamental interest and the potential application of a new generation of electronic devices. Here we review the exotic…
In the search for stable topological semimetals with clean band profiles, we have screened all the 3$d$ metal-intercalated transition-metal dichalcogenides (3dI-TMDCs) by performing hybrid-functional-based ab initio calculations. Two…
Topological semimetals (TSMs) have attracted numerous attention due to their exotic physical properties and great application potentials. Silicon-based TMSs are of particularly importance because of their high abundance, nontoxicity and…
Three-dimensional (3D) topological Dirac semimetals (TDSs) represent a novel state of quantum matter that can be viewed as '3D graphene'. In contrast to two-dimensional (2D) Dirac fermions in graphene or on the surface of 3D topological…
By using first-principles calculations, we propose that WC-type ZrTe is a new type of topological semimetal (TSM). It has six pairs of chiral Weyl nodes in its first Brillouin zone, but it is distinguished from other existing TSMs by having…
Previously known three-dimensional Dirac semimetals (DSs) occur in two types -- topological DSs and nonsymmorphic DSs. Here we present a novel three-dimensional DS that exhibits both features of the topological and nonsymmorphic DSs. We…
We theoretically propose that, the single crystal formed TaS is a new type of topological semimetal, hosting ring-shaped gapless nodal lines and triply degenerate points (TDPs) in the absence of spin-orbit coupling (SOC). In the presence of…
We present a prediction of the Dirac semimetal (DSM) phase in MgTa2N3 based on first-principles calculations and symmetry analysis. In this material, the Fermi level is located exactly at the Dirac point without additional Fermi surface…
Topological nodal-line semimetals (TNLSMs) are characterized by symmetry-protected band crossings extending along one-dimensional lines in momentum space. The nodal lines exhibit a variety of possible configurations, such as nodal ring,…
The discovery of topological semimetal phase in three-dimensional (3D) systems is a new breakthrough in topological material research. Dirac nodal-line semimetal is one of the three topological semimetal phases discovered so far; it is…
Topological band theory predicts a $\mathbb{Z}$ classification of three-dimensional (3D) Dirac semimetals (DSMs) at the single-particle level. Namely, an arbitrary number of identical bulk Dirac nodes will always remain locally stable and…
Based on the first-principles study, we report a new set of topological semimetals (TiS, TiSe, TiTe, HfS, HfSe, HfTe and ZrS) which show the co-existence of a nodal-ring and triply-degenerate points. The two-fold degenerate one-dimensional…
Featuring exotic quantum transport and surface states, topological semimetals can be classified into nodal-point, nodal-line, and nodal-surface semimetals according to the degeneracy and dimensionality of their nodes. However, a topological…
We theoretically study three-dimensional topological semimetals (TSMs) with nodal lines protected by crystalline symmetries. Compared with TSMs with point nodes, e.g., Weyl semimetals and Dirac semimetals, where the conduction and the…
Spin-gapless semimetals (SGSMs), which generate 100\% spin polarization, are viewed as promising semi-half-metals in spintronics with high speed and low consumption. We propose and characterize a new $\mathbb{Z_{\mathrm{2}}}$ class of…
Magnetic topological semimetals (TSMs) allow for an effective control of the topological electronic states by tuning the spin configuration, and therefore are promising materials for next-generation electronic and spintronic applications.…