Related papers: Locality of Interatomic Forces in Tight Binding Mo…
We studied the thermodynamic behaviors of non-interacting bosons and fermions trapped by a scale-invariant branching structure of adjustable degree of heterogeneity. The full energy spectrum in tight-binding approximation was analytically…
The expressions for the superfluid density have been discussed in both weak and strong coupling approaches. The numerical calculations of temperature and isotope composition dependencies have been performed for a number of High-Tc…
We consider some aspects of a standard model employed in studies of many-body localization: interacting spinless fermions with quenched disorder, for non-zero filling fraction, here on $d$-dimensional lattices. The model may be recast as an…
Finite temperature properties of a non-Fermi liquid system is one of the most challenging probelms in current understanding of strongly correlated electron systems. The paradigmatic arena for studying non-Fermi liquids is in one dimension,…
Topological insulators and their intriguing edge states can be understood in a single-particle picture and can as such be exhaustively classified. Interactions significantly complicate this picture and can lead to entirely new insulating…
We introduce a machine-learning density-functional-theory formalism for the spinless Hubbard model in one dimension at both zero and finite temperature. In the zero-temperature case this establishes a one-to-one relation between the site…
We theoretically consider non-interacting fermions confined to optical lattices and apply a lattice amplitude modulation that we choose to be either homogeneous or of superlattice geometry. We study the atom excitation rate to higher Bloch…
A one dimensional experiment in granular dynamics is carried out to test the thermodynamic theory of weakly excited granular systems [Hayakawa and Hong, Phys. Rev. Lett. {\bf 78}, 2764(1997)] where granular particles are treated as spinless…
We derive an effective quasiparticle tight-binding model which is able to describe with high accuracy the low-energy electronic structure of Sr2RuO4 obtained by means of low temperature angle resolved photoemission spectroscopy. Such…
An application of the tight binding approximation is presented for the description of electronic structure and interatomic force in magnetic iron, both pure and containing hydrogen impurities. We assess the simple canonical d-band…
The goal of this paper is to relate the capacitance matrix formalism to the tight-binding approximation. By doing so, we open the way to the use of mathematical techniques and tools from condensed matter theory in the mathematical and…
Parameterized tight-binding models fit to first principles calculations can provide an efficient and accurate quantum mechanical method for predicting properties of molecules and solids. However, well-tested parameter sets are generally…
The Kagome lattice Fermi-Hubbard model is one of the most physically rich, and at the same time most challenging, models to study in strongly-correlated physics. Among its special features are geometric frustration and a flat energy band…
The formal link between the linear combination of atomic orbitals approach to density functional theory and two-center Slater-Koster tight-binding models is used to derive an orthogonal $d$-band tight-binding model for iron with only two…
The low temperature dependence of the spin and charge susceptibilities of an anisotropic electron system in two dimensions is analyzed. It is shown that the presence of inflection points at the Fermi surface leads, generically, to a $ T…
One of the hallmarks of topological insulators is the correspondence between the value of its bulk topological invariant and the number of topologically protected edge modes observed in a finite-sized sample. This bulk-boundary…
A one dimensional experiment in granular dynamics is carried out to test the thermodynamic theory of weakly excited granular systems [Hayakawa and Hong, Phys. Rev. Lett. 78, 2764(1997)] where granular particles are treated as spinless…
Molecular dynamics simulations were carried out to test the thermodynamic theory of weakly excited, two-dimensional granular systems [Hayakawa and Hong, Phys. Rev. Lett. 78, 2764 (1997)], where granular materials are viewed as a collection…
The semi-classical approach leading to the Thomas-Fermi (TF) model provides a simple universal thermodynamic description of the electronic cloud surrounding the nucleus in an atom. This model is known to be exact at the limit of…
Atomic scale simulations at finite temperature are an ideal approach to study the thermodynamic properties of magnetic transition metals. However, the development of interatomic potentials explicitly taking into account magnetic variables…