相关论文: Assessing The Band Gap Problem By Improving Upon T…

Calculations of formation energies and charge transition levels of defects routinely rely on density functional theory (DFT) for describing the electronic structure. Since bulk band gaps of semiconductors and insulators are not well…

We present a device architecture of hybrid-edge and dual-gated quantum point contact. We demonstrate improved electrostatic control over the separation, position, and coupling of each broken-symmetry compressible strip in graphene. Via…

Two-band electronic structures with a valence and a conduction band separated by a tunable energy gap and with pairing of electrons in different channels can be relevant to investigate the properties of two-dimensional multiband…

We compare the quasiparticle band structure for a model insulator obtained from the fluctuation exchange approximation (FEA) with the eigenvalues of the corresponding density functional theory (DFT) and local density approximation (LDA).…

A theory is presented for the modification of bandgaps in atomically thin boron nitride (BN) by attractive interactions mediated through phonons in a polarizable substrate, or in the BN plane. Gap equations are solved, and gap enhancements…

Integrating seminal ideas of London, Feynman, and Feenberg, this paper continues the development of an ab initio theory of the lambda transition in liquid 4He. The theory is based on variational determination of a trial density matrix…

Lattices with a basis can host crystallographic defects which share the same topological charge (e.g.~the Burgers vector $\vec b$ of a dislocation) but differ in their microscopic structure of the core. We demonstrate that in insulators…

The paper develops a new integral micromorphic elastic continuum model, which can describe dispersion properties of band-gap metamaterials, i.e., metamaterials that inhibit propagation of waves in a certain frequency range. The enrichment…

Locally resonant metamaterials are characterized by bandgaps at wavelengths that are much larger than the lattice size, enabling low-frequency vibration attenuation. Typically, bandgap analyses and predictions rely on the assumption of…

We prove that the Kane-Mele-Hubbard model with purely imaginary next-nearest-neighbor hoppings has a particle-hole symmetry at half-filling. Such a symmetry has interesting consequences including the absence of charge and spin currents…

Fractional quantum anomalous Hall effects realized in twisted bilayer MoTe$_2$ and multilayer-graphene-based moir\'e heterostructures have captured a tremendous growth of interest. In this work, we propose that rhombohedral multilayer…

A quantum system exhibiting $\mathcal{PT}$ symmetry is a Bose-Einstein condensate in a double-well potential with balanced particle gain and loss, which is described in the mean-field limit by a Gross-Pitaevskii equation with a complex…

We generalize the extension and trace results of Bj\"orn-Bj\"orn-Shanmugalingam \cite{BBS21} to the setting of complete noncompact doubling metric measure spaces and their uniformized hyperbolic fillings. This is done through a…

We compare the ability of four popular hybrid density functionals (B3LYP, B3PW91, HSE, and PBE0) for predicting band gaps of semiconductors and insulators over a large benchmark set using a consistent methodology. We observe no significant…

Over the years, great efforts have been devoted in introducing a sizable and tunable band gap in graphene for its potential application in next-generation electronic devices. The primary challenge in modulating this gap has been the absence…

The spontaneous baryogenesis mechanism by Cohen, Kaplan and Nelson is reconsidered taking into account the transport of particles inside the electroweak bubble walls. Using linear response theory, we calculate the modifications on the…

Gapless topological phases have attracted significant interest across both quantum and classical systems owing to their novel physics and promising applications. However, the search for ideal gapless topological nodes inside a clear bandgap…

Space-time reflection symmetry (PT symmetry) in non-Hermitian electronic models has drawn much attention over the past decade mainly because it guarantees that the band structures calculated under open boundary conditions be the same as…

In a double-well potential, a Bose-Einstein condensate exhibits Josephson oscillations or self-trapping, depending on its initial preparation and on the ratio of inter-particle interaction to inter-well tunneling. Here, we elucidate the…

Reconstructing a density of states or similar distribution from moments or continued fractions is an important problem in calculating the electronic and vibrational structure of defective or non-crystalline solids. For single bands a…