相关论文: Dynamical Functions of a 1D Correlated Quantum Liq…

In this contribution we present some results of potential energy surfaces of actinide and transfermium nuclei from multi-dimensional constrained relativistic mean field (MDC-RMF) models. Recently we developed multi-dimensional constrained…

Using the Ogata-Shiba wave function, the spectral functions of the one-dimensional infinite U Hubbard model are calculated for various concentrations. It is shown that the ``shadow band'' feature due to 2k_F fluctuations becomes more…

To explore the applicability of orbital-free density functional theory (OF-DFT) in nuclear physics, we perform a systematic benchmark of 36 one-point kinetic energy density functionals, which are originally developed for electron systems in…

Direct-current resistivity is a key probe for the physical properties of materials. In metals, Fermi-liquid (FL) theory serves as the basis for understanding transport. A $T^2$ behavior of the resistivity is often taken as a signature of FL…

The primary computational challenge when simulating nonadiabatic ab initio molecular dynamics is the unfavorable compute costs of electronic structure calculations with molecular size. Simple electronic structure theories, like…

Motivated by recent theoretical and experimental studies on the role of flatbands in the thermoelectric properties of Ni$_3$In$_{1-x}$Sn$_x$ compounds, we investigate electron transport in two minimal one-dimensional flatband models, the…

We study the one-particle properties of the t-J model within the framework of Vollhardt's dynamical mean field theory. By introducing an AB - sublattice structure we explicitely allow for a broken symmetry for the spin degrees of freedom…

This work explores the use of joint density-functional theory, a new form of density-functional theory for the ab initio description of electronic systems in thermodynamic equilibrium with a liquid environment, to describe electrochemical…

Quarkonia, the bound states of heavy quark-antiquark pairs, are important tools for studying the quark-gluon plasma (QGP). In this study, we examine the behavior of in-medium quarkonium bound states in the QGP by analyzing their spectral…

The influence of the combined effects of substrate-induced strain, finite size and electron irradiation-induced defects have been studied on individual micron-sized domains of the organic charge transfer compound…

We formulate and implement Cyclic Density Functional Theory (Cyclic DFT) -- a self-consistent first principles simulation method for nanostructures with cyclic symmetries. Using arguments based on Group Representation Theory, we rigorously…

Electron-electron ($e$-$e$) and electron-phonon ($e$-ph) interactions are challenging to describe in correlated materials, where their joint effects govern unconventional transport, phase transitions, and superconductivity. Here we combine…

Spectral functions that are used in neutrino event generators to model quasielastic (QE) scattering from nuclear targets include Fermi gas, Local Thomas Fermi gas (LTF), Bodek-Ritchie Fermi gas with high momentum tail, and the…

We study a set of many-body wave-functions of Fermions that are naturally written using momentum space basis and allow for quantum superposition of Fermion occupancy, $\{n_{\bf k}\}$. This {enables} us to capture the fluctuations of the…

Kinetic properties of a two dimensional model of fermions interacting with antiferromagnetic spin excitations near the quantum critical point (QCP) are considered. The temperature or doping are assumed to be sufficiently high, such that the…

We calculate spectral functions within the t-J model as relevant to cuprates in the regime from low to optimum doping. On the basis of equations of motion for projected operators an effective spin-fermion coupling is derived. The self…

We study the dynamical properties of spinless fermions on the checkerboard lattice. Our main interest is the limit of large nearest-neighbor repulsion $V$ as compared with hopping $|t|$. The spectral functions show broad low-energy…

We calculate the finite temperature single hole spectral function and the spin dynamic structure factor of spinfull one-dimensional Tomonaga-Luttinger liquid. Analytical expressions are obtained for a number of special cases. We also…

A fermion ground state energy functional is set up in terms of particle density, relative pair density, and kinetic energy tensor density. It satisfies a minimum principle if constrained by a complete set of compatibility conditions. A…

We present a review of the basic ideas and techniques of the spectral density functional theory which are currently used in electronic structure calculations of strongly-correlated materials where the one-electron description breaks down.…