相关论文: Exact Density Functionals in One Dimension
Large strongly correlated systems provide a challenge to modern electronic structure methods, because standard density functionals usually fail and traditional quantum chemical approaches are too demanding. The density-matrix…
We apply density functional theory to study the freezing of superfluid {$^{4}\rm{He}$}, charged bosons and charged fermions at zero temperature. We employ accurate Quantum Monte Carlo data for the linear response function in the uniform…
We introduce an exactly solvable model of a fermi gas in one dimension and compute the momentum distribution exactly. This is based on a generalisation of the ideas of bosonization in one dimension. It is shown that in the RPA limit(the…
By combining methods of kinetic and density functional theory, we present a description of molecular fluids which accounts for their microscopic structure and thermodynamic properties as well as for the hydrodynamic behavior. We focus on…
We consider a lattice gas in spaces of dimensionality $\mathcal{D}=1,2,3$. The particles are subject to a hardcore exclusion interaction and an attractive pair interaction that satisfies Gauss' law as do Newtonian gravity in…
We present a systematic derivation of relativistic lattice kinetic equations for finite-mass particles, reaching close to the zero-mass ultra-relativistic regime treated in the previous literature. Starting from an expansion of the…
We present a new approach to derive the connectivity properties of pairwise interacting n-body systems in thermal equilibrium. We formulate an integral equation that relates the pair connectedness to the distribution of nearest neighbors.…
A previous analysis of scaling, bounds, and inequalities for the non-interacting functionals of thermal density functional theory is extended to the full interacting functionals. The results are obtained from analysis of the related…
The exact interaction energy of a many-electron system is determined by the electron pair density, which is not well-approximated in standard Kohn-Sham density functional models. Here we study the (complicated but well-defined) exact…
A mixed basis approach based on density functional theory is extended to one-dimensional(1D) systems. The basis functions here are taken to be the localized B-splines for the two finite non-periodic dimensions and the plane waves for the…
Exact calculations are performed on the two-dimensional strongly interacting, unpolarized, uniform Fermi gas with a zero-range attractive interaction. Two auxiliary-field approaches are employed which accelerate the sampling of…
We derive exact relations for $N$ spin-1/2 fermions with zero-range or short-range interactions, in continuous space or on a lattice, in $2D$ or in $3D$, in any external potential. Some of them generalize known relations between energy,…
A one-dimensional, driven lattice gas with a freely moving, driven defect particle is studied. Although the dynamics of the defect are simply biased diffusion, it disrupts the local density of the gas, creating nontrivial nonequilibrium…
We use density-matrix renormalization group, applied to a one-dimensional model of continuum Hamiltonians, to accurately solve chains of hydrogen atoms of various separations and numbers of atoms. We train and test a machine-learned…
Within density-functional theory, the local-density approximation (LDA) correlation functional is typically built by fitting the difference between the near-exact and Hartree-Fock (HF) energies of the uniform electron gas (UEG), together…
The functional flow equations for the Legendre effective action, with respect to changes in a smooth cutoff, are approximated by a derivative expansion; no other approximation is made. This results in a set of coupled non-linear…
Action functionals describing relativistic perfect fluids are presented. Two of these actions apply to fluids whose equations of state are specified by giving the fluid energy density as a function of particle number density and entropy per…
We obtain wave functionals of free real and complex scalar fields on a 1+1 dimensional lattice by explicitly calculating the path integral for transition from one field configuration to another. The obtained expressions are useful for…
We prove a generalized dynamical duality for identical particles in one dimension (1D). Namely, 1D systems with arbitrary statistics -- including bosons, fermions and anyons -- approach the same momentum distribution after long-time…
We present a metric-space approach to quantify the performance of density-functional approximations for interacting many-body systems and to explore the validity of the Hohenberg-Kohn-type theorem on fermionic lattices. This theorem…