相关论文: Frontier Orbitals and Quasiparticle Energy Levels …
Quantum interference (QI) effects in molecular junctions may be used to obtain large thermoelectric responses. We study the electrical conductance G and the thermoelec- tric response of a series of molecules featuring a quinoid core using…
This overview describes several science cases at the Electron-Ion-Collider (EIC) experiment which are traditional to general particle physics. It has an emphasis on connections between future measurements at the EIC and the physics topics…
Ionic liquid ion sources are a promising technology that can be used for many applications from space propulsion to focused ion beam microetching. Ionic liquid ion sources produce ion beams by extracting single ions and metastable solvated…
We perform first-principles path integral Monte Carlo (PIMC) and density functional theory molecular dynamics (DFT-MD) calculations to explore warm dense matter states of LiF. Our simulations cover a wide density-temperature range of…
The cuprate high-temperature superconductors are known to host a wide array of effects due to interactions and disorder. In this work, we look at some of the consequences of these effects which can be visualized by scanning tunneling…
In this study it is demonstrated that a simple picture of the QCD gluon liquid emerges in the dynamical quasiparticle model that specifies the active degrees of freedom in the time-like sector and yields a potential energy density in the…
The GW approximation within many-body perturbation theory is the state of the art for computing quasiparticle energies in solids. Typically, Kohn-Sham (KS) eigenvalues and eigenfunctions, obtained from a Density Functional Theory (DFT)…
We investigate the dissociation and ionization equilibria of deuterium fluid over a wide range of temperatures and densities. The partition functions for molecular and atomic species are evaluated, in a statistical-mechanically consistent…
A generalised quasilinear (GQL) approximation (Marston \emph{et al.}, \emph{Phys. Rev. Lett.}, vol. 116, 104502, 2016) is applied to turbulent channel flow at $Re_\tau \simeq 1700$ ($Re_\tau$ is the friction Reynolds number), with emphasis…
Ionic liquids offer unique bulk and interfacial characteristics as battery electrolytes. Our continuum approach naturally describes the electrolyte on a macroscale. An integral formulation for the molecular repulsion,which can be…
We present and compare several many-body methods as applied to two-dimensional quantum dots with circular symmetry. We calculate the approximate ground state energy using a harmonic oscillator basis optimized by Hartree-Fock (HF) theory and…
We investigate the superfluid transition temperature of quasi-two-dimensional imbalanced Fermi gases beyond the mean-field approximation, through the second-order (or induced) interaction effects. For a balanced Fermi system the transition…
We study properties of a gluon plasma above the critical temperature $T_c$ in a generalized quasi-particle approach with a Lorentz spectral function. The model parameters are determined by a fit of the entropy $s$ to lattice QCD data. The…
The ab initio quasirelativistic Hartree-Fock method developed specifically for the calculation of spectral parameters of heavy atoms and highly charged ions is used to derive transition data for multicharged tungsten ion. The configuration…
We discuss a method to calculate with quantum molecular dynamics simulations the rate of energy exchanges between electrons and ions in two-temperature plasmas, liquid metals and hot solids. Promising results from this method were recently…
A theory is developed for the evolution of the non-equilibrium distribution of quasiparticles when the scattering rate decreases due to particle collisions. We propose a "modified one-collision approximation" which is most effective for…
We design dipolar quantum many-body Hamiltonians that will facilitate the realization of exotic quantum phases under current experimental conditions achieved for polar molecules. The main idea is to modulate both single-body potential…
We present a new methodology to analyze complicated multi-physics simulations by introducing a fictitious parameter. Using the method, we study quantum mechanical aspects of an organic molecule in water. The simulation is variationally…
Theory predicts that quasiparticle tunneling between the counter-propagating edges in a fractional quantum Hall state can be used to measure the effective quasiparticle charge e* and dimensionless interaction parameter g, and thereby…
We employ Landau's theory of normal Fermi liquids to study the quasiparticle interaction in nuclear matter in the vicinity of saturation density. Realistic low-momentum nucleon-nucleon interactions evolved from the Idaho N3LO chiral…