Related papers: A quantitative Hohenberg-Kohn theorem and the unex…

This article generalizes the notion of the local density of a many-body system to introduce collective coordinates as explicit degrees of freedom. It is shown that the energy of the system can be expressed as a functional of this object.…

We discuss the recent developments in the generalized continuous Heisenberg ferromagnet model formulated as a nonrelativistic field theory defined on the target space of the coadjoint orbits. Hermitian symmetric spaces are special because…

We investigate the static and dynamical behavior of 1D interacting fermions in disordered Hubbard chains, contacted to semi-infinite leads. The chains are described via the repulsive Anderson-Hubbard Hamiltonian, using static and…

Using the density matrix renormalization group algorithm, we study the model of spinless fermions with nearest-neighbor interaction on a ring in the presence of disorder. We determine the spatial decay of the density induced by a defect…

The object of the present study is the integrated density of states of a quantum particle in multi-dimensional Euclidean space which is characterized by a Schr{\"o}dinger operator with magnetic field and a random potential which may be…

The standard (``fine-grained'') interpretation of quantum density functional theory, in which densities are specified with infinitely-fine spatial resolution, is mathematically unruly. Here, a coarse-grained version of DFT, featuring…

We study both static and transport properties of model quantum dots, employing density functional theory as well as (numerically) exact methods. For the lattice model under consideration the accuracy of the local-density approximation…

We show that deep neural networks can be integrated into, or fully replace, the Kohn-Sham density functional theory scheme for multi-electron systems in simple harmonic oscillator and random external potentials with no feature engineering.…

We present a density functional theory (DFT) for lattice models with local electron-electron (e-e) and electron-phonon (e-ph) interactions. Exchange-correlation potentials are derived via dynamical mean field theory for the…

Let $n$ be a fixed positive integer and $h: \{1,2,\ldots,n\} \rightarrow \{1,2,\ldots,n\}$ a Hessenberg function. The main results of this paper are twofold. First, we give a systematic method, depending in a simple manner on the Hessenberg…

A recognized trend of research investigates generalizations of the Hadamard's inversion theorem to functions that may fail to be differentiable. In this vein, the present paper explores some consequences of a recent result about the…

We explore whether quantum field theory can be understood as the statistical mechanics of a time-reversal-invariant stochastic generalization of Hamiltonian dynamics. The motivation for this project, started with this paper, is to assign…

In this study, we address the inverse problem of recovering the Lam\'e parameters ($\lambda, \mu$) and the density $\rho$ of a medium from the Neumann-to-Dirichlet map for any dimension $d\geq 2$. This inverse problem finds its motivation…

Given an algebraic function field $F|K$ and a place $\wp$ on $K$, we prove that the places that are composite with extensions of $\wp$ to finite extensions of $K$ lie dense in the space of all places of $F$, in a strong sense. We apply the…

Kohn-Sham density functional theory is the base of modern computational approaches to electronic structures. Their accuracy vitally relies on the exchange-correlation energy functional, which encapsulates electron-electron interaction…

Ensemble density functional theory extends the usual Kohn-Sham machinery to quantum state ensembles involving ground- and excited states. Recent work by the authors [Phys. Rev. Lett. 119, 243001 (2017); 123, 016401 (2019)] has shown that…

An overview of several recent developments in density functional theory for classical inhomogeneous liquids is given. We show how Levy's constrained search method can be used to derive the variational principle that underlies density…

We present a kinetic-energy density-functional theory and the corresponding kinetic-energy Kohn-Sham (keKS) scheme on a lattice and show that by including more observables explicitly in a density-functional approach already simple…

We introduce a formulation of optimal transport problem for distributions on function spaces, where the stochastic map between functional domains can be partially represented in terms of an (infinite-dimensional) Hilbert-Schmidt operator…

The universal density functional $F$ of density-functional theory is a complicated and ill-behaved function of the density-in particular, $F$ is not differentiable, making many formal manipulations more complicated. Whilst $F$ has been well…