Related papers: Regular-Triangle Trimer and Charge Order Preservin…
In this review, I present the electronic properties of the beta-pyrochlore oxide CsW2O6 and other related materials. At 215 K, CsW2O6 exhibits an electronic phase transition to a nonmagnetic insulating state, which exhibits a complex…
Recently, a Verwey-type transition in the mixed-valence alkali sesquioxide Cs$_4$O$_6$ was deduced from the charge ordering of molecular peroxide O$_2^{2-}$ and superoxide O$_2^-$ anions accompanied by the structural transformation and a…
We study \textit{ab initio} a pyrochlore compound, CsW$_{2}$O$_{6}$, which exhibits a yet unexplained metal-insulator transition. We find that (1) the reported low-$T$ structure is likely inaccurate and the correct structure has a twice…
Spin-orbit interaction established itself as a major role player for emergent phenomena in modern condensed matter including a topological insulator, spin liquid and spin-dependent transports. However, its function is rather limited to…
Correlated electron materials with molecular orbital states extending over transition metal clusters can host multiferroicity, spin frustration, and unconventional insulating phases. However, the fundamental criteria that govern cluster…
Electronic structure calculations of the Verwey ground state of magnetite, Fe3O4, using density functional theory with treatment of on-site Coulomb interactions (DFT+U scheme) are reported. These calculations use the recently-published…
The electronic orders appearing in condensed matter systems are originating from the precise arrangement of atoms constituting the crystal as well as their nature. This teneous relationship can lead to highly different phases in condensed…
We develop a self-contained theoretical framework that classifies the topological phases and critical phenomena of classical pyrochlore magnets with arbitrary spin $S$, subject to competing exchange and single-ion anisotropies. In the…
We consider a system of 2D fermions on a triangular lattice with well separated electron and hole pockets of similar sizes, centered at certain high-symmetry-points in the Brillouin zone. We first analyze Stoner-type spin-density-wave (SDW)…
The recently discovered vanadium-based kagome metals $A$V$_{3}$Sb$_{5}$ ($A$~=~K,~Rb,~Cs) exhibit superconductivity at low-temperatures and charge density wave (CDW) order at high-temperatures. A prominent feature of the charge ordered…
Inspired by recent discovery of metallic $d$-wave altermagnetism in KV$_2$Se$_2$O, we develop a self-consistent microscopic many-body calculation of density-wave order for an itinerant altermagnetic metal. We show that the strong $d$-wave…
Even though the rare-earth tritellurides are tetragonal materials with a quasi two dimensional (2D) band structure, they have a "hidden" 1D character. The resultant near-perfect nesting of the Fermi surface leads to the formation of a…
Tl$_{2}$Mn$_{2}$O$_{7}$ pyrochlores present colossal magnetoresistance (CMR) around the long range ferromagnetic ordering temperature (T$_{C}$). The character of this magnetic phase transition has been determined to be first order, by…
Understanding the driving mechanisms behind metal-insulator transitions (MITs) is a critical step towards controlling material's properties. Since the proposal of charge-order-induced MIT in magnetite Fe3O4 in 1939 by Verwey, the nature of…
Cd2Os2O7 shows a peculiar metal-insulator transition at 227 K with magnetic ordering in a frustrated pyrochlore lattice, but its magnetic structure in the ordered state and the transition origin are yet uncovered. We observed a commensurate…
The transition metal dichalcogenide 6R-TaS$_{2}$ offers a natural platform for studying the interplay among charge density wave (CDW) order, superconductivity, and transport anomalies. Recent findings reveal that, in the intermediate…
Motivated by recent experiments reporting unconventional collective modes in the charge density-wave (CDW) state of rare-earth tritellurides $R$Te$_3$, we derive from a multi-orbital microscopic model on the square net a CDW Ginzburg-Landau…
The recently discovered layered kagome metals AV$_3$Sb$_5$(A=K, Rb, Cs) have attracted much attention because of their unique combination of superconductivity, charge density wave (CDW) order, and nontrivial band topology. The CDW order…
The crystal structure of Fe3O4 below the 122 K Verwey transition has been refined using high-resolution X-ray and neutron powder diffraction data. The refinements give direct evidence for charge ordering (CO) over four independent…
The newly discovered ternary chalcogenide superconductor Bi$_2$Rh$_3$Se$_2$ has attracted growing attention, which provides an opportunity to explore the interplay between charge density wave (CDW) order and superconductivity. However,…