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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

Within ``orbital-free'' density functional theory, it is essential to develop general kinetic energy density (KED), denoted as $t(\mathbf{r})$. This is usually done by empirical corrections and enhancements, gradient expansions, machine…

Quantum Physics · Physics 2022-10-26 Abdulaziz H. Al-Aswad , Fahhad H. Alharbi

This review gives an overview of effective field theory (EFT) as applied at finite density, with a focus on nuclear many-body systems. Uniform systems with short-range interactions illustrate the ingredients and virtues of many-body EFT and…

Nuclear Theory · Physics 2009-11-19 R. J. Furnstahl , G. Rupak , T. Schaefer

Basis sets of atomic orbitals are very efficient for density functional calculations but lack a systematic variational convergence. We present a variational method to optimize numerical atomic orbitals using a single parameter to control…

Condensed Matter · Physics 2009-11-07 E. Anglada , J. Soler , J. Junquera , E. Artacho

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…

Chemical Physics · Physics 2009-10-17 Bin Liu , Jerome K. Percus

The calculation of the effective potential for fixed-end and toroidal rigid $p$-branes is performed in the one-loop as well as in the $1/d$ approximations. The analysis of the involved zeta-functions (of inhomogeneous Epstein type) which…

High Energy Physics - Theory · Physics 2009-09-17 E. Elizalde , S. D. Odintsov

We establish robust exponential convergence for $rp$-Finite Element Methods (FEMs) applied to fourth order singularly perturbed boundary value problems, in a \emph{balanced norm} which is stronger than the usual energy norm associated with…

Numerical Analysis · Mathematics 2023-09-20 Torsten Linß , Christos Xenophontos

First-principles density functional theory (DFT) codes which employ a localized basis offer advantages over those which use plane-wave bases, such as better scaling with system size and better suitability to low-dimensional systems. The…

Materials Science · Physics 2024-11-25 Daniel Bennett , Michele Pizzochero , Javier Junquera , Efthimios Kaxiras

We analyze an optimal stopping problem with a series of inequality-type and equality-type expectation constraints in a general non-Markovian framework. We show that the optimal stopping problem with expectation constraints (OSEC) in an…

Optimization and Control · Mathematics 2023-02-10 Erhan Bayraktar , Song Yao

The Variation Evolving Method (VEM), which seeks the optimal solutions with the variation evolution principle, is further developed to be more flexible in solving the Optimal Control Problems (OCPs) with terminal constraint. With the…

Systems and Control · Computer Science 2018-02-01 Sheng Zhang , Kai-Feng He , Fei Liao

We consider an elliptic optimal control problem where the objective functional contains an integral along a surface of codimension 1, also known as a hypersurface. In particular, we use a fidelity term that encourages the state to take…

Numerical Analysis · Mathematics 2014-11-19 C. Brett , A. S. Dedner , C. M. Elliott

We critically examine the applicability of the effective potential within dynamical situations and find, in short, that the answer is negative. An important caveat of the use of an effective potential in dynamical equations of motion is an…

High Energy Physics - Phenomenology · Physics 2024-05-17 Nathan Herring , Shuyang Cao , Daniel Boyanovsky

Optimal Power Flow (OPF) is a core optimization problem in power system operation and planning, aiming to minimize generation costs while satisfying physical constraints such as power flow equations, generator limits, and voltage limits.…

Machine Learning · Computer Science 2025-12-02 Xuezhi Liu

We demonstrate the existence of different density-density functionals designed to retain selected properties of the many-body ground state in a non-interacting solution starting from the standard density functional theory ground state. We…

Other Condensed Matter · Physics 2009-11-13 F. A. Reboredo , P. R. C. Kent

The deepening of the penetration of renewable energy is challenging how power system operators cope with their associated variability and uncertainty. The inherent flexibility of dispathchable assets present in power systems, which is often…

Optimization and Control · Mathematics 2024-08-19 Mohamed Awadalla , François Bouffard

We propose a density functional to find the ground state energy and density of interacting particles, where both the density and the pair density can adjust in the presence of an inhomogeneous potential. As a proof of principle we formulate…

Strongly Correlated Electrons · Physics 2015-06-11 J. Lorenzana , Z. -J. Ying , V. Brosco

In this paper, we present an analytical approach for the synthesis of ellipsoidal probabilistic reachable sets of saturated systems subject to unbounded additive noise. Using convex optimization methods, we compute a contraction factor of…

Optimization and Control · Mathematics 2025-09-03 Carlo Karam , Matteo Tacchi-Bénard , Mirko Fiacchini

Effective field theories offer a powerful method to unify diverse models under a small set of control parameters, allowing systematic expansions around well-established theories. These techniques, developed in particle physics, were…

High Energy Physics - Theory · Physics 2025-10-02 Thomas Colas

A global optimization approach for solving non-monotone equilibrium problems (EPs) is proposed. The class of (regularized) gap functions is used to reformulate any EP as a constrained global optimization program and some bounds on the…

Optimization and Control · Mathematics 2020-02-28 Stefano Lucidi , Mauro Passacantando , Francesco Rinaldi

Obvious strategyproofness (OSP) is an appealing concept as it allows to maintain incentive compatibility even in the presence of agents that are not fully rational, e.g., those who struggle with contingent reasoning [Li, 2015]. However, it…

Computer Science and Game Theory · Computer Science 2017-02-21 Diodato Ferraioli , Carmine Ventre