Related papers: Incommensurate host-guest structures in compressed…
We employ {\it{ab-initio}} calculations to investigate the charge density waves in single-layer NbSe$_2$, and we explore how they are affected by transition metal atoms. Our calculations reproduce the observed orthorhombic phase in…
Cohesion mechanism of cubic approximant crystals of newly discovered binary quasicrystals, Cd$_6$M (M=Yb and Ca), are studied theoretically. It is found that stabilization due to alloying is obtained if M is an element with low-lying…
The nickelate compound Y_{2}BaNiO_{5} is a spin-1 Haldane-gap antiferromagnet. The compound is doped with holes on replacing the off-chain Y^{3+} ions by Ca^{2+} ions. Inelastic neutron scattering (INS) experiments reveal the existence of…
Structural distortions in cuprate materials give a natural origin for anisotropies in electron properties. We study a modified one-band t-J model in which we allow for different hoppings and antiferromagnetic couplings in the two spatial…
We report the formation of a binary crystal of hard polyhedra due solely to entropic forces. Although the alternating arrangement of octahedra and tetrahedra is a known space-tessellation, it had not previously been observed in…
Motivated by the recent observations of incommensurate magnetic order and electric polarization in YBaCuFeO5 up to temperatures TN2 as high as 230K [1,2] we report here for the first time a model for the incommensurate magnetic structure of…
Quasi-1D materials Bi$_{4}$X$_{4}$ (X=Br,I) are prototype weak topological insulators (TI) in the $\beta$ phase. For the $\alpha$ phases, recent high-throughput database screening suggests that Bi$_{4}$Br$_{4}$ is a rare higher-order TI…
Neutron diffraction on a triple-axis spectrometer and a small-angle neutron scattering instrument is used to study the magnetic phase transition in tetragonal Ba$_2$CuGe$_2$O$_7$ at zero magnetic field. In addition to the incommensurate…
We present a comprehensive first-principles investigation of the structural, electronic, vibrational, and topological properties of tellurium across its dimensional hierarchy, including bulk trigonal Te-I, two-dimensional tellurene…
We argue that key characteristics of the enigmatic transition at $T_0= 17.5K $ in $URu_2Si_2$ indicate that the hidden order is a density wave formed within a band of composite quasiparticles, whose detailed structure is determined by local…
We present the [X/H] trends as function of the elemental condensation temperature Tc in 88 planet host stars and in a volume-limited comparison sample of 33 dwarfs without detected planetary companions. We gathered homogeneous abundance…
Superconductivity is observed in a composite of rhombohedral crystalline bismuth nanoparticles imbedded in an insulating porous opal host via electrical transport and AC magnetic susceptibility. The onset of superconductivity in this system…
An Ising model with competing interaction is used to study the appearance of incommensurate phases in the basal plane of an hexagonal closed-packed structure. The calculated mean-field phase diagram reveals various 1q-incommensurate and…
A tetragonal phase is predicted for Hf2O3 and Zr2O3 using density functional theory. Starting from atomic and unit cell relaxations of substoichiometric monoclinic HfO2 and ZrO2, such tetragonal structures are only reached at zero…
We studied the electronic structure of the heavy fermion compound Yb(Ru$_{1-x}$Rh$_{x}$)$_2$Ge$_2$ with $x=0$ and nominally $x=0.125$ using ARPES and LDA calculations. We find a valence band structure of Yb corresponding to a non-integer…
There is a long history of studying Ramsey theory using the algebraic structure of the Stone-\v{C}ech compactification of discrete semigroup. It has been shown that various Ramsey theoretic structures are contained in different algebraic…
We report a hidden density-wave instability in the trimer-based ruthenate Ba4Ru3O10, previously regarded as a pure antiferromagnet with a phase transition at TA=100 K. This transition is manifested in lattice parameters, transport,…
The observation of large intrinsic anomalous Hall conductivity (AHC) in the non-collinear antiferromagnetic (AFM) phase of the Weyl semimetal Mn$_3$Sn generates enormous interest in uncovering the entanglement between the real space…
In all archetypical reported (001)-oriented perovskite heterostructures, it has been deduced that the preferential occupation of two-dimensional electron gases is in-plane $d_\textrm{xy}$ state. In sharp contrast to this, the investigated…
We study physical situations when one or two "guest" arbitrarily-charged particles are immersed in the bulk of a classical electrolyte modelled by a Coulomb gas of positive/negative unit point-like charges, the whole system being in thermal…