相关论文: Beyond the Rosenfeld Functional: Loop Contribution…

It is known for quite some time that approximate density functional (ADF) theories fail disastrously when describing the dis-sociative symmetric radical cations R2+. Considering this dissociation limit, previous work has shown that…

Diffusion-a measure of dynamics, and entropy-a measure of disorder in the system, are found to be intimately correlated in many systems, and the correlation is often strongly non-linear. We explore the origin of this complex dependence by…

The paper establishes a functional version of the Hoeffding combinatorial central limit theorem. First, a pre-limiting Gaussian process approximation is defined, and is shown to be at a distance of the order of the Lyapounov ratio from the…

In the setup of i.i.d.~observations and a real valued differentiable functional~$T$, locally asymptotic upper bounds are derived for the power of one-sided tests (simple, versus large values of~$T$)and for the confidence probability of…

In this paper we develop a new set of results based on a nonlocal gradient jointly inspired by the Riesz s-fractional gradient and Peridynamics, in the sense that its integration domain depends on a ball of radius delta > 0 (horizon of…

We study inhomogeneous random graphs with a finite type space. For a natural generalization of the model as a dynamic network-valued process, the paper establishes the following results: (a) Functional central limit theorems for the…

We study the phase transition of the three-dimensional complex |psi|^4 theory by considering the geometrically defined vortex-loop network as well as the magnetic properties of the system in the vicinity of the critical point. Using…

This articles presents a simulation study of the applicability of the Rosenfeld entropy scaling to the systems which can not be approximated by effective hard spheres. Three systems are studied: Herzian spheres, Gauss Core Model and soft…

Radial basis functions (RBFs) are prominent examples for reproducing kernels with associated reproducing kernel Hilbert spaces (RKHSs). The convergence theory for the kernel-based interpolation in that space is well understood and optimal…

We construct a density functional theory (DFT) for the sticky hard sphere (SHS) fluid which, like Rosenfeld's fundamental measure theory (FMT) for the hard sphere fluid [Phys. Rev. Lett. {\bf 63}, 980 (1989)], is based on a set of weighted…

We study fluids of hard rods in the vicinity of hard spherical and cylindrical surfaces at densities below the isotropic-nematic transition. The Onsager second virial approximation is applied, which is known to yield exact results for the…

This paper focuses on vector-valued composite functionals, which may be nonlinear in probability. Our primary goal is to establish central limit theorems for these functionals when mixed estimators are employed. Our study is relevant to the…

We study analytically the constraints of the conformal bootstrap on the low-lying spectrum of operators in field theories with global conformal symmetry in one and two spacetime dimensions. We introduce a new class of linear functionals…

We consider the one dimensional classical Ising model in a symmetric dichotomous random field. The problem is reduced to a random iterated function system for an effective field. The D_q-spectrum of the invariant measure of this effective…

We prove general results about separation and weak$^\#$-convergence of boundedly finite measures on separable metric spaces and Souslin spaces. More precisely, we consider an algebra of bounded real-valued, or more generally a $*$-algebra…

The intrinsic Helmholtz free-energy functional, the centerpiece of classical density functional theory, is at best only known approximately for 3D systems. Here we introduce a method for learning a neuralnetwork approximation of this…

The Central Limit Theorem does not hold for strongly correlated stochastic variables, as is the case for statistical systems close to criticality. Recently, the calculation of the probability distribution function (PDF) of the magnetization…

Sequences of experimental ground-state energies are mapped onto concave patterns cured from convexities due to pairing and/or shell effects. The same patterns, completed by a list of excitation energies, can be used to give numerical…

Bounded potentials are good models to represent the effective two-body interaction in some colloidal systems, such as dilute solutions of polymer chains in good solvents. The simplest bounded potential is that of penetrable spheres, which…

We extend a previous analysis of spatial correlation functions for classical electromagnetic vector fields near a perfectly conducting boundary [PRE, vol. 73, 036604 (2006)] to the case of an isotropic semi-infinite medium with planar…