Frequency-dependent conductivity of concentrated electrolytes: A stochastic density functional theory.

The response of ionic solutions to time-varying electric fields, quantified by a frequency-dependent conductivity, is essential in many electrochemical applications. Yet, it constitutes a challenging problem due to the combined effect of Coulombic interactions, hydrodynamics, and thermal fluctuations. Here, we study the frequency-dependent conductivity of ionic solutions using a stochastic density functional theory.

Physicist's view on the unbalanced k-cardinality assignment problem.

The k-cardinality unbalanced assignment problem asks for assigning k "agents" to k "tasks" on a one-to-one basis, while minimizing the total cost associated with the assignment, with the total number of agents N and the total number of tasks M possibly different and larger than k. While many exact algorithms have been proposed to find such an optimal assignment, these methods are computationally prohibitive when the problem is large. We propose an approach to solving the k-cardinality assignment problem using techniques adapted from statistical physics.

Analyzing the Geometry and Dynamics of Viral Structures: A Review of Computational Approaches Based on Alpha Shape Theory, Normal Mode Analysis, and Poisson-Boltzmann Theories.

The current SARS-CoV-2 pandemic highlights our fragility when we are exposed to emergent viruses either directly or through zoonotic diseases. Fortunately, our knowledge of the biology of those viruses is improving. In particular, we have more and more structural information on virions, i.

Conductance of concentrated electrolytes: Multivalency and the Wien effect.

The electric conductivity of ionic solutions is well understood at low ionic concentrations of up to a few millimolar but becomes difficult to unravel at higher concentrations that are still common in nature and technological applications. A model for the conductivity at high concentrations was recently put forth for monovalent electrolytes at low electric fields. The model relies on applying a stochastic density-functional theory and using a modified electrostatic pair-potential that suppresses unphysical, short-range electrostatic interactions.