相关论文: Electronic nematicity in FeSe: a first-principles …
We revisit bulk FeSe through the systematic first-principles electronic structure calculations. We find that there are a series of staggered $n$-mer antiferromagnetic (AFM) states with corresponding energies below that of the collinear AFM…
An SDW antiferromagnetic (SDW-AF) low temperature phase transition is generally observe and the AF spin fluctuations are considered to play an important role for the superconductivity paring mechanism in FeAs superconductors. However, a…
Nematicity plays an important role in the physics of iron-based superconductors (IBS). Its microscopic origin and in particular its importance for the mechanism of high-temperature superconductivity itself are highly debated. A crucial…
One of central issues in iron-based superconductors is the role of structural change to the superconducting transition temperature (T_c). It was found in FeSe that the lattice strain leads to a drastic increase in T_c, accompanied by…
Among the family of intercalated transition-metal dichalcogenides (TMDs), Fe$_{x}$NbS$_2$ is found to possess unique current-induced resistive switching behaviors, tunable antiferromagnetic states, and a commensurate charge order, all of…
Superconductivity in the iron pnictides emerges from metallic parent compounds exhibiting intertwined stripe-type magnetic order and nematic order, with itinerant electrons suggested to be essential for both. Here we use X-ray and neutron…
We analyze superconductivity in a multi-orbital fermionic system near the onset of a nematic order, using doped FeSe as an example. We associate the nematic order with spontaneous polarization between $d_{xz}$ and $d_{yz}$ orbitals. We…
The electronic nematic order characterized by broken rotational symmetry has been suggested to play an important role in the phase diagram of the high temperature cuprates. We study the interplay between the electronic nematic order and a…
In BaNiS2 a Dirac nodal-line band structure exists within a two-dimensional Ni square lattice system, in which significant electronic correlation effects are anticipated. Using scanning tunneling microscopy, we discover signs of…
Among the numerous 2D system that can be prepared via exfoliation, iron phosphorus trisulfide (FePS3) attracts a lot of attention recently due to its broad-range photoresponse, its unusual Ising-type magnetic order and possible applications…
Materials with correlated electrons often respond very strongly to external or internal influences, leading to instabilities and states of matter with broken symmetry. This behavior can be studied theoretically either by evaluating the…
To understand the rich electronic phase diagram in FeSe under pressure that vividly demonstrates the strong interplay between the nematicity, magnetism and superconductivity, we analyze the electronic states by including the higher-order…
We consider a two-dimensional electron gas (2DEG) formed at a near-ferroelectric interface and strongly coupled to polar phonons. Through a self-consistent microscopic many-body calculation, we show that the coupled system stabilizes a…
Systems with strong electron-phonon couplings typically exhibit various forms of charge order, while strong electron-electron interactions lead to magnetism. We use determinant quantum Monte Carlo (DQMC) calculations to solve a model on a…
We report a comprehensive ARPES study of NaFeAs, a prototypical parent compound of the Fe-based superconductors. By mechanically detwinning the samples, we show that in the nematic phase (below the structural transition at $T_s$ = 54 K but…
Detwinning of magnetic (nematic) domains in Fe-based superconductors has so far only been obtained through mechanical straining, which considerably perturbs the ground state of these materials. The recently discovered non-mechanical…
The nature of the nematic state in FeSe remains one of the major unsolved mysteries in Fe- based superconductors. Both spin and orbital physics have been invoked to explain the origin of this phase. Here we present experimental evidence for…
The Fe$_{n}$GeTe$_{2}$ systems are newly discovered two-dimensional van-der-Waals materials, exhibiting magnetism at room temperature. The sub-systems belonging to Fe$_{n}$GeTe$_{2}$ class are special because they show site-dependent…
Electron transfer with changing occupation in the 4f subshell poses a considerable challenge for quantitative predictions in quantum chemistry. Using the example of cerium oxide, we identify the main deficiencies of common…
The momentum dependence of the nematic order parameter is an important ingredient in the microscopic description of iron-based high-temperature superconductors. While recent reports on FeSe indicate that the nematic order parameter changes…