Related papers: A Semiclassical Model for Molecular Localization i…

The interaction of mass-selected atomic clusters and nanoparticles with surfaces attracts strong interest in view of fundamental research and technological applications. Understanding dynamics of the deposition process is important for…

In this paper, we extend a method recently reported [Phys. Rev. E 87, 042921 (2012)] for the calculation of the eigestates of classically highly chaotic systems to cases of mixed dynamics, i.e. those presenting regular and irregular motions…

For the weakly interacting one-dimensional multi-particle Anderson model in the continuum space of configurations, we prove the spectral exponential and the strong dynamical localization. The results require the interaction amplitude to be…

We present a theory for the steady-state dynamics of a two-dimensional system of spherically symmetric active Brownian particles. The derivation of the theory consists of two steps. First, we integrate out the self-propulsions and obtain a…

Determining the stability of molecules and condensed phases is the cornerstone of atomistic modelling, underpinning our understanding of chemical and materials properties and transformations. Here we show that a machine learning model,…

A binary system of classical charged particles interacting through a dipole repulsive potential and confined in a two-dimensional hardwall trap is studied by Brownian dynamics simulations. We found that the presence of small particles…

We consider electronic transport through break-junctions bridged by a single molecule in the Kondo regime. We describe the system by a two-channel Anderson model. We take the tunneling matrix elements to depend on the position of the…

We investigate the dynamics of two-component Bose-Josephson junction composed of atom-molecule BECs. Within the semiclassical approximation, the multi-degree of freedom of this system permits chaotic dynamics, which does not occur in…

We prove that for a combined system of classical and quantum particles, it is possible to write a dynamics for the classical particles that incorporates in a natural way the Boltzmann equilibrium population for the quantum subsystem. In…

Semiclassical electrodynamics is an appealing approach for studying light-matter interactions, especially for realistic molecular systems. However, there is no unique semiclassical scheme. On the one hand, intermolecular interactions can be…

Mapping equations of motion of the highly exited classical atom in a monochromatic field are generalized for the two-frequency microwave field. Analysis of the obtained equations indicates to the weak sensitivity of the position of the…

We study slow dynamics of particles moving in a matrix of immobile obstacles using molecular dynamics simulations. The glass transition point decreases drastically as the obstacle density increases. At higher obstacle densities, the…

An adaptive modeling method (AMM) that couples a deep neural network potential and a classical force field is introduced to address the accuracy-efficiency dilemma faced by the molecular simulation community. The AMM simulated system is…

The "melting" of self-formed rigid structures made of a small number of interacting classical particles confined in an irregular two-dimensional space is investigated using Monte Carlo simulations. It is shown that the interplay of…

In this short note we study Spin-Boson Models from the Quasi-Classical standpoint. In the Quasi-Classical limit, the field becomes macroscopic while the particles it interacts with, they remain quantum. As a result, the field becomes a…

The dynamics of the spin-boson Hamiltonian is considered in the stochastic approximation. The Hamiltonian describes a two-level system coupled to an environment and is widely used in physics, chemistry and the theory of quantum measurement.…

Using molecular dynamics simulations we study the temperature-density phase diagram of a simple model system of particles in two dimensions. In addition to translational degrees of freedom, each particle has two internal states and…

Due to entropic effects, it is possible that generic high-energy states of a quantum or classical system are ordered. This leads to spontaneous symmetry breaking at arbitrarily high temperatures. We present minimal models of entropic order…

The progress in two-dimensional materials has led to rapid experimental developments in quantum plasmonics, where light is manipulated using plasmons. Although numerical methods can be used to quantitatively describe plasmons in spatially…

We investigate dynamics of semi-quantal spin systems in which quantum bits are attached to classically and possibly stochastically moving classical particles. The interaction between the quantum bits takes place when the respective…