The rapid development of parallel computing systems made it possible to recreate and
predict physical processes on computers. Nowadays, computer simulations complement …

Das Buch behandelt Methoden des wissenschaftlichen Rechnens in der Moleküldynamik,
einem Bereich, der in vielen Anwendungen der Chemie, der Biowissenschaften, der …

We devise a new, two-level discrete-particle model to simulate ordered colloidal structures
with vastly different scales. We use the molecular dynamics paradigm with a Lennard-Jones …

In the mesoscale, mixing dynamics involving immiscible fluids is truly an outstanding
problem in many fields, ranging from biology to geology, because of the multiscale nature …

We propose a concept for a homogenous computational model in carrying out cross-scale
numerical experiments on liquids. The model employs the particle paradigm and comprises …

We carried out large-scale molecular-dynamics simulations of the classical Rayleigh–Taylor
(RT) phenomenon in a Lennard-Jones molecular liquid. We have observed from these …

Molecular dynamics is a well-established technique for simulating complex many-particle
systems in many areas of physics, chemistry, and astrophysics. The huge computational …

The authors show how using particle simulations one can try to solve the problems out of
reach of classical models based on the matter, momenta and energy flows continuity. Being …

A two-level modeling colloidal structure method combining the molecular dynamics (MD)
and dissipative particle dynamics (DPD) techniques is considered. The results of simulation …

The general definition of particles paradigm, comprises the broad range of techniques,
which use particles as basic objects. The main features of particles paradigm; simplicity …