English
Related papers

Related papers: Existence of Density Functionals for Excited State…

200 papers

It has been shown by H. Bethe more than 70 years ago that the number of excited states of a Fermi gas grows, at high excitation energies $Q$, like the exponential of the square root of $Q$. This result takes into account only the average…

Nuclear Theory · Physics 2009-11-11 Patricio Leboeuf

Density functional theory (DFT) is the de facto approach for predicting self-consistent-field electronic structures of ground-state configurations of complex atoms, molecules, and solids and providing their property data for materials…

Materials Science · Physics 2024-01-30 Zi-Kui Liu

Finite temperature density functional theory requires representations for the internal energy, entropy, and free energy as functionals of the local density field. A central formal difficulty for an orbital-free representation is…

Statistical Mechanics · Physics 2011-05-12 James W. Dufty , S. B. Trickey

We present a first principles strategy for developing state-specific density functional approximations for excited states. We first clarify why approaches based on conventional ground state approximations miss density-driven correlations,…

Chemical Physics · Physics 2025-06-09 Tim Gould , Stephen G Dale , Leeor Kronik , Stefano Pittalis

Aspects of Density Functional Resonance Theory (DFRT) [Phys. Rev. Lett. \textbf{107}, 163002 (2011)], a recently developed complex-scaled version of ground-state Density Functional Theory (DFT), are studied in detail. The asymptotic…

Quantum Physics · Physics 2015-06-04 Daniel L. Whitenack , Adam Wasserman

We introduce a density functional formalism to study the ground-state properties of strongly-correlated dipolar and ionic ultracold bosonic and fermionic gases, based on the self-consistent combination of the weak and the strong coupling…

Using a central limit theorem for arrays of interacting quantum systems, we give analytical expressions for the density of states and the partition function at finite temperature of such a system, which are valid in the limit of infinite…

Statistical Mechanics · Physics 2009-11-10 Michael Hartmann , Guenter Mahler , Ortwin Hess

In this work we present an extended version of the Friedrichs Model, which includes fermion-boson couplings. The set of fermion bound states is coupled to a boson field with discrete and continuous components. As a result of the coupling…

Nuclear Theory · Physics 2009-11-13 O. Civitarese , M. Gadella

The Hohenberg-Kohn theorem of density functional theory (DFT) for the case of electrons interacting with an external magnetic field (that couples to spin only) is examined in more detail than previously. A unexpected generalization is…

Strongly Correlated Electrons · Physics 2009-10-31 H. Eschrig , W. E. Pickett

The physics of the state at even denominator fractional fillings of Landau levels depends on the Coulomb pseudopotentials, and produces, in different GaAs Landau levels, a composite fermion Fermi sea, a stripe phase, or, possibly, a paired…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Csaba Toke , Jainendra K. Jain

We prove that the electron density function of a real physical system can be uniquely determined by its values on any finite subsystem. This establishes the existence of a rigorous density-functional theory for any open electronic system.…

Quantum Physics · Physics 2007-05-23 Xiao Zheng , Fan Wang , GuanHua Chen

We present a formalism that represents pure states, mixtures and generalized states as functionals on an algebra containing the observables of the system. Along these states, there are other functionals that decay exponentially at all times…

Quantum Physics · Physics 2015-06-26 M. Castagnino , M. Gadella , R. Id Beta , R. Laura

The fractional quantum Hall effect remains a captivating area in condensed matter physics, characterized by strongly correlated topological order, which manifests as fractionalized excitations and anyonic statistics. Numerical simulations,…

Strongly Correlated Electrons · Physics 2025-10-27 Yi Yang , Yayun Hu , Zi-Xiang Hu

We propose a general variational fermionic many-body wavefunction that generates an effective Hamiltonian in a quadratic form, which can then be exactly solved. The theory can be constructed within the density functional theory framework,…

Strongly Correlated Electrons · Physics 2020-10-30 Xindong Wang , Xiao Chen , Liqin Ke , Hai-Ping Cheng , B. N. Harmon

We show that the particle density, $\rho(\mathbf{r})$, and the paramagnetic current density, $\mathbf{j}^{p}(\mathbf{r})$, are not sufficient to determine the set of degenerate ground-state wave functions. This is a general feature of…

Chemical Physics · Physics 2018-02-28 Andre Laestadius , Erik I. Tellgren

Using a generalized proper-time method, we obtain expressions for the fermion density and the QED effective Lagrangian for an external magnetic field at finite chemical potential. The effective Lagrangian and the density are here written in…

High Energy Physics - Phenomenology · Physics 2009-10-28 D. Persson , Vad. Zeitlin

Friedel oscillations appear in density of Fermi gases due to Pauli exclusion principle and translational symmetry breaking nearby a defect or impurity. In confined Fermi gases, this symmetry breaking occurs also near to boundaries. Here,…

Quantum Gases · Physics 2019-11-12 Coskun Firat , Altug Sisman , Alhun Aydin

Variations in distinct restricted spaces of wave functions generate distinct density functionals. In particular, angular momentum projected Slater determinants define a new density functional, compatible simultaneously with angular momentum…

Nuclear Theory · Physics 2007-05-23 B. G. Giraud

Typical density functional theory (DFT) and approximations thereto solve the many-electron ground state problem by working from a numerically efficient non-interacting Kohn-Sham reference system; and benefit from useful minimization…

Chemical Physics · Physics 2025-04-02 Tim Gould

The analysis of the terminating bands has been performed in the relativistic mean field framework. It was shown that nuclear magnetism provides an additional binding to the energies of the specific configuration and this additional binding…

Nuclear Theory · Physics 2010-11-23 A. V. Afanasjev