相关论文: Efficient hydrogen evolution reaction due to topol…
Ionic behaviors, including ion distributions and hydration characteristics at solid-liquid interfaces, are important research interests in many important applications, such as electric double-layer capacitors and water lubrication. Here, we…
We study the correlation between the value of the triple Higgs coupling and the nature of the electroweak phase transition. We use an effective potential approach, including higher order, non-renormalizable terms coming from integrating out…
We show the emergence of topological Bogoliubov bosonic excitations in the relatively strong coupling limit of an LC (inductance-capacitance) one-dimensional quantum circuit. This dimerized chain model reveals a ${\cal Z}_2$ local symmetry…
The ground states of noninteracting fermions in one-dimension with chiral symmetry form a class of topological band insulators, described by a topological invariant that can be related to the Zak phase. Recently, a generalization of this…
Spatial confinement of electronic topological surface states (TSS) in topological insulators poses a formidable challenge because TSS are protected by time-reversal symmetry. In previous works formation of a gap in the electronic spectrum…
Excess charge on polar surfaces of ionic compounds is commonly described by the two-dimensional electron gas (2DEG) model, a homogeneous distribution of charge, spatially-confined in a few atomic layers. Here, by combining scanning probe…
Our work is concerned with the case of the solar molecule CN which presents conspicuous profiles of scattering polarization. We start by calculating accurate PES for the singlet and triplet electronic ground states in order to characterize…
We study topological features of interacting spin- 1 2 particles in one-dimensional state-dependent optical lattices. Due to the co-translational symmetry, we introduce the center-of-mass Zak phase with the help of center-of-mass momentum.…
In integrating topological insulators (TIs) with conventional materials, one crucial issue is how the topological surface states (TSS) will behave in such heterostructures. We use first-principles approaches to establish accurate tunability…
Van der Waals (vdW) heterostructures have attracted intense interest worldwide as they offer several routes to design materials with novel features and wide-ranging applications. Unfortunately, at present, vdW heterostructures are…
Laser- assisted antihydrogen formation cross sections (differential and total) via the three - body recombination (TBR) process in a plasma of antiprotons and positrons are studied for the ground and excited states . Significantly large…
Platinum is a nearly perfect catalyst for the hydrogen evolution reaction, and its high activity has conventionally been explained by its close-to-thermoneutral hydrogen binding energy (G~0). However, many candidate non-precious metal…
Many dipolar topological structures have been experimentally demonstrated in (PbTiO$_3$)$_n$/(SrTiO$_3$)$_n$ superlattices, such as flux-closure, vortice, and skyrmion. In this work, we employ deep potential molecular dynamics (MD) to…
Disorder and defective coordination in the catalytic plane are crucial for enhancing the Hydrogen Evolution Reaction (HER) on two-dimensional catalysts. Amorphous materials are disordered, making them catalytically adaptive for many…
We examine a method of studying the Z polarization in $H\to ZZ \to \ell^+ \ell^- \nu \bar{\nu}$ in proton-proton collisions at the Large Hadron Collider (LHC). Included are the dominant contributions: gluon fusion production of the Higgs…
We present a verified computational model of the SH3 domain transition state (TS) ensemble. This model was built for three separate SH3 domains using experimental s in all-atom protein folding simulations. While averaging over all…
Surface states refer to electronic states emerging as a solid material terminates at a surface, and can be present in many systems. Despite their spatial proximity to material surfaces, surface states have been largely overlooked in…
Determining the nature of surface roughness and electrode pore structure on H2 bubble evolution rate and quantity, and bubble trapping under electrolytic conditions is important for quantifying useful gas production during total water…
We study the electroweak phase transition in the alignment limit of the CP-conserving two-Higgs-doublet model (2HDM) of Type I and Type II. The effective potential is evaluated at one-loop, where the thermal potential includes Daisy…
The performance of gold nanoparticles (NPs) in applications depends critically on the structure of the NP-solvent interface, at which the electrostatic surface polarization is one of the key characteristics that affects hydration, ionic…