Related papers: Nodal Loop and Nodal Surface States in Ti3Al Famil…
We propose that CaP3 family of materials, which include CaP3, CaAs3, SrP3, SrAs3 and BaAs3 can host a three-dimensional topological nodal line semimetal states. Based on first-principle calculations and kp model analysis, we show that a…
The electronic and topological properties of single-layer X3YZ6 (X=Nb,Ta, Y=Si,Ge,Sn, Z=S,Se,Te) materials have been studied with the aid of first principles calculations. This kind of materials belong to topological semimetals (TMs) with…
Nodal-loop semimetals are materials in which the conduction and valence bands cross on a one-dimensional loop in the reciprocal space. For the nodal-loop character to manifest in physical properties, it is desired that the loop is close to…
Owing to the natural compatibility with current semiconductor industry, silicon allotropes with diverse structural and electronic properties provide promising platforms for the next-generation Si-based devices. After screening 230…
Topological nodal-line semimetals are exotic conductors that host symmetry-protected conducting nodal-lines in their bulk electronic spectrum and nontrivial drumhead states on the surface. Based on first-principles calculations and an…
Topological semimetals in ferromagnetic materials have attracted enormous attention due to the potential applications in spintronics. Using the first-principles density functional theory together with an effective lattice model, here we…
Coexistence of topological elements in a topological metal/semimetal (TM) has gradually attracted attentions. However, the non-topological factors always mess up the Fermi surface and cover interesting topological properties. Here, we find…
Symmetry plays a major role in all disciplines of physics. Within the field of topological materials there is a great interest in understanding how the mechanics of crystalline and internal symmetries protect crossings between the…
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…
Based on first-principles calculations and an effective Hamiltonian analysis, we systematically investigate the electronic and topological properties of alkaline-earth compounds $AX_2$ ($A$=Ca, Sr, Ba; $X$=Si, Ge, Sn). Taking BaSn$_2$ as an…
Topological metal/semimetals (TMs) have emerged as a new frontier in the field of quantum materials. A few two-dimensional (2D) boron sheets have been suggested as Dirac materials, however, to date TMs made of three-dimensional (3D) boron…
It has been realized over the past two decades that topological nontriviality can be present not only in insulators but also in gapless semimetals, the most prominent example being Weyl semimetals in three dimensions. Key to topological…
The realization of Dirac and Weyl physics in solids has made topological materials one of the main focuses of condensed matter physics. Recently, the topic of topological nodal line semimetals, materials in which Dirac or Weyl-like…
Topological semimetals (TSMs) featuring symmetry-protected band degeneracies have attracted considerable attention due to their exotic quantum properties and potential applications. While nodal line (NL) and nodal surface (NS) semimetals…
Topological nodal-line semimetals with exotic quantum properties are characterized by symmetry-protected line-contact bulk band crossings in the momentum space. However, in most of identified topological nodal-line compounds, these…
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…
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…
Nodal-line metals and semimetals, as interesting topological states of matter, have been mostly studied in nonmagnetic materials. Here, based on first-principles calculations and symmetry analysis, we predict that fully spin-polarized Weyl…
Using ab initio calculations based on density-functional theory and effective model analysis, we propose that the trigonal YH3(Space Group: P-3c1) at ambient pressure is a node-line semimetal when spin-orbit coupling (SOC) is ignored. This…
Topological nodal-line semimetals (NLSs) are unique materials, which harbor one-dimensional line nodes along with the so-called drumhead surface states arising from nearly dispersionless two dimensional surface bands. However, a direct…