Related papers: Solvation in the Large Box Limit
When the scattering length is proportional to the distance from the center of the system, two particles are shown to be trapped about the center. Furthermore, their spectrum exhibits discrete scale invariance, whose scale factor is…
The decay of correlations in ionic fluids is a classical problem in soft matter physics that underpins applications ranging from controlling colloidal self-assembly to batteries and supercapacitors. The conventional wisdom, based on…
Solid-liquid interfaces are at the heart of many modern-day technologies and provide a challenge to many materials simulation methods. A realistic first-principles computational study of such systems entails the inclusion of solvent…
Motivated by recent bounds for charge diffusion in critical matter, we investigate the question: What sets the scale for charge diffusion in a scale-invariant system? To make our statements precise, we analyze the diffusion pole in an…
Atomic number ($A$) and energy ($\roots$) scaling exponents of multiplicity and transverse energy in heavy ion collisions are analytically derived in the perturbative QCD + saturation model. The exponents depend on the small-$x$ behaviour…
A new theoretical approach for the calculation of optical properties of complex solutions is proposed. It is based on a dielectric matrix with included small metallic inclusions (less than 3 nm) of spherical shape. We take into account the…
We report adaptive resolution molecular dynamics simulations of a flexible linear polymer in solution. The solvent, i.e., a liquid of tetrahedral molecules, is represented within a certain radius from the polymer's center of mass with a…
We discuss the feasibility of the embedded cluster approach for it ab-initio calculations of charge exchange between ions and a LiF surface. We show that the discrete density of valence states in embedded clusters converges towards the…
Solvation of ions is ubiquitous on our planet. Solvated ions have a profound effect on the behavior of ionic solutions, which is crucial in nature and technology. Experimentally, ions have been classified into "structure makers" or…
Determining the solvation free energies of single ions in water is one of the most fundamental problems in physical chemistry and yet many unresolved questions remain. In particular, the ability to decompose the solvation free energy into…
We investigate the interplay between electronic screening inside a metal and screening by a polar molecular solvent, focusing on their impact on the charge induced by an ion and the solvent structure at the interface. To that end, we…
We propose a simple linear scaling expression in reciprocal space for evaluating the ion--electron potential of crystalline solids. The expression replaces the long-range ion--electron potential with an equivalent localized charge…
Molecular conduction operating in dielectric solvent environments are often described using kinetic rates based on Marcus theory of electron transfer at a molecule-metal electrode interface. However, the successive nature of charge transfer…
We consider a system of charged particles moving on the real line driven by electrostatic interactions. Since we consider charges of both signs, collisions might occur in finite time. Upon collision, some of the colliding particles are…
High energy collision of massive bodies is investigated without fine tuning. We study multiple collisions of two spherical concentric shells in a gravitationally bound system and calculate the center of mass energy between the shells. We…
By using the recently generalized version of Newton Shell Theorem [3] analytical equations are derived to calculate the electric interaction energy between two charged spheres, a small one is located within a larger one, and each sphere is…
Modelling electrolytes accurately on both a nanoscale and cell level can contribute to improving battery chemistries.[Armand and Tarascon, Nature, 2008, 451, 652-657] We previously presented a thermodynamic continuum model for…
Basic theoretical issues relating to the response of confined relativistic particles are considered including the scaling of the response in spacelike and timelike regions of momentum transfer and the role of final state interactions. A…
Quantum correlations are essential to the emergent behaviors of quantum systems, supporting key phenomena such as localization or delocalization of particles, quantum avalanches in many-body localized systems, and quantum information…
We examine the impact of quantum confinement on the interaction potential between two charges in two-dimensional semiconductor nanosheets in solution. The resulting effective potential depends on two length scales, namely the thickness $d$…