Related papers: Generalizing The Mean Spherical Approximation as a…
We here discuss the emergence of Quasi Stationary States (QSS), a universal feature of systems with long-range interactions. With reference to the Hamiltonian Mean Field (HMF) model, numerical simulations are performed based on both the…
In this paper we develop a stochastic boundary conditions (SBC) for event-driven molecular dynamics simulations of a finite volume embedded within an infinite environment. In this method, we first collect the statistics of…
A perturbation approach based on the first-order mean spherical approximation (FMSA) is proposed. It consists in adopting a hard-sphere plus short-range attractive Yukawa fluid as the novel reference system, over which the perturbative…
In this paper we predict sea surface salinity (SSS) in the Arctic Ocean based on satellite measurements. SSS is a crucial indicator for ongoing changes in the Arctic Ocean and can offer important insights about climate change. We…
We provide an error bound for approximating the time evolution of N bosons by a generalized nonlinear Hartree equation. The bosons are assumed to interact via permutation symmetric bounded many-particle potentials and the initial…
Mixture-of-Experts (MoE) embedding models combine expert outputs using weighted linear summation, implicitly assuming a linear subspace structure in the embedding space. This assumption is shown to be inconsistent with the geometry of…
Mean spherical approximation (MSA), second-order Barker-Henderson (BH) perturbation theory and thermodynamic perturbation theory (TPT) for associating fluids in combination with BH perturbation theory are applied to the study of the…
The Multi-scale Entanglement Renormalization Ansatz (MERA) is a tensor network that provides an efficient way of variationally estimating the ground state of a critical quantum system. The network geometry resembles a discretization of…
Inferring properties of macroscopic solutions from molecular simulations is complicated by the limited size of systems that can be feasibly examined with a computer. When long-ranged electrostatic interactions are involved, the resulting…
We apply recently developed smooth boundary conditions to the quantum Monte Carlo simulation of the two-dimensional Hubbard model. At half-filling, where there is no sign problem, we show that the thermodynamic limit is reached more rapidly…
A computation of the quotient of shear viscosity to entropy density, or KSS number $\eta/s$ is performed, in the non-relativistic and classical regime, first in Chiral Perturbation Theory, and then in the $SO(g+1)/SO(g)$ Non-Linear Sigma…
The Bose-Hubbard model effectively describes bosons on a lattice with on-site interactions and nearest-neighbour hopping, serving as a foundational framework for understanding strong particle interactions and the superfluid to Mott…
Lattice quasi-periodicity is easily realized with ultracold atoms in optical lattices and has been used to study delocalization-localization transition at low dimensions. Models with true disorder, however, remains largely unrealized in…
Ion partitioning between different compartments (\emph{e.g.} a porous material and a bulk solution reservoir), known as Donnan equilibrium, plays a fundamental role in various contexts such as energy, environment, or water treatment. The…
In Isliker et al. (2000b), an extended cellular automaton (X-CA) model for solar flares was introduced. In this model, the interpretation of the model's grid-variable is specified, and the magnetic field, the current, and an approximation…
Thermodynamic properties of charge-stabilised colloidal suspensions are commonly modeled by implementing the mean-field Poisson-Boltzmann (PB) theory within a cell model. This approach models a bulk system by a single macroion, together…
The Poisson-Boltzmann equation offers an efficient way to study electrostatics in molecular settings. Its numerical solution with the boundary element method is widely used, as the complicated molecular surface is accurately represented by…
Chemical thermodynamic models of solvent and solute activities predict the equilibrium behaviour of aqueous solutions. How-ever, these models are semi-empirical. They represent micro-scale ion and solvent behaviours that control the…
We study the boundary layer solution to singular perturbation problems involving Poisson-Boltzmann (PB) type equations with a small parameter $\epsilon$ in general bounded smooth domains (including multiply connected domains) under the…
The nonlocal Allen-Cahn equation with nonlocal diffusion operator is a generalization of the classical Allen-Cahn equation. It satisfies the energy dissipation law and maximum bound principle (MBP), and is important for simulating a series…