Related papers: K2Mo3As3 is a Multi-Gap Electron-Phonon Supercondu…
We propose an extended Hubbard model with three molecular orbitals on a hexagonal lattice with $D_{3h}$ symmetry to study recently discovered superconductivity in A$_2$Cr$_3$As$_3$ (A=K,Rb,Cs). Effective pairing interactions from paramagnon…
We report the superconductivity of the CaSn3 single crystal with a AuCu3-type structure, namely cubic space group Pm3m. The superconducting transition temperature TC=4.2 K is determined by the magnetic susceptibility, electrical…
We perform a comparative study of the KCr3As3 and the K2Cr3As3 quasi 1D compounds, and show that the strong interplay between the lattice and the spin degrees of freedom promotes a new collinear ferrimagnetic ground state within the chains…
Two possible phases of superhard material BC3 originating from the cubic diamond structure are investigated by ab initio pseudopotential density functional method using generalized gradient approximation (GGA). We calculate their elastic…
Recently, multifold fermions characterized by band crossings with multifold degeneracy and Fermi surfaces with nontrivial Chern numbers have been discovered experimentally in AlPt[arXiv:1812.03310] and…
We discuss the possibility of coexistence of spin density wave (antiferromagnetism) and triplet superconductivity as a particular example of a broad class of systems where the interplay of magnetism and superconductivity is important. We…
We investigate the electronic and other properties of the hypothetical compound LiFeSb in relation to superconducting LiFeAs and FeSe using density functional calculations. The results show that LiFeSb in the LiFeAs structure would be…
The non-centrosymmetric superconductors Li2Pd3B and Li2Pt3B show different superconducting properties despite having the same crystal symmetry. Motivated by experimental results, we investigate the spin susceptibility of non-centrosymmetric…
Two-dimensional superconductivity at KTaO3 (KTO) heterointerfaces has sparked intensive investigations since its discovery, yet whether the (001)-oriented KTO interface hosts superconductivity remains to be elucidated. Here, we provide…
The three-dimensional band structure and superconducting gap of Ba0.6K0.4Fe2As2 are studied with high-resolution angle-resolved photoemission spectroscopy. In contrast to previous results, we have identified three hole-like Fermi surfaces…
We present a comprehensive first-principles investigation of a hypothetical cubic Pm-3m phase of the ternary hydride NaAlH3, focusing on its lattice dynamics, electronic structure, and electron-phonon-mediated superconducting properties at…
We report muon-spin relaxation measurements on SrFeAsF, which is the parent compound of a newly discovered iron-arsenic-fluoride based series of superconducting materials. We find that this material has very similar magnetic properties to…
Structural and electronic characterization of (Ca0.67Sr0.33)Fe2As2 has been performed as a func- tion of pressure up to 12 GPa using conventional and designer diamond anvil cells. The compound (Ca0.67Sr0.33)Fe2As2 behaves intermediate…
We calculate superconducting gaps and quasiparticle density of states of YNi$_2$B$_2$C in the framework of the density functional theory for superconductors to investigate the origin of a highly anisotropic superconducting gaps in this…
Superconductivity and magnetism in the non-centrosymmetric heavy fermion compound CePt$_3$Si and related materials are theoretically investigated. Based on the randam phase approximation (RPA) analysis for the extended Hubbard model we…
We investigate the superconductivity in two-dimensional electron systems formed in SrTiO3 nanostructures. Our the- oretical analysis is based on the three-orbital model, which takes into account t2g orbitals of Ti ions. Because of the…
Quasi-one-dimensional electron systems display intrinsic instability towards long-range ordered phases at sufficiently low temperatures. The superconducting orders are of particular interest as they can possess either singlet or triplet…
HfTe3 single crystal undergoes a charge-density-wave (CDW) transition at TCDW = 93 K without the appearance of superconductivity (SC) down to 50 mK at ambient pressure. Here, we determined its CDW vector q = 0.91(1) a* + 0.27(1) c* via…
I study the lattice dynamics and electron-phonon coupling in non-centrosymmetric quasi-one-dimensional K$_2$Cr$_3$As$_3$ using density functional theory based first principles calculations. The phonon dispersions show stable phonons without…
Spin-triplet superconductors are novel materials capable of harboring Majorana bound states that can be used in topological quantum computing. However, such bulk materials are still rare. Here we review the results that established K2Cr3As3…