Shear viscosity is one of the key subjects of molecular modeling studies since this quality is
used in the development of lubricants. In this paper, we use molecular dynamics methods to …

A brief overview of the key methods for analyzing the structure of three-dimensional (3D)
matter is given by using as an example melts of simple model systems like Lennard-Jones …

Understanding the mechanisms which relate properties of liquid and solid phases is crucial
for fabricating new advanced solid materials, such as glasses, quasicrystals and high …

Using molecular dynamics simulations with embedded atom model potential, we study
structural evolution of Cu 64.5 Zr 35.5 alloy during the cooling in a wide range of cooling …

Using molecular dynamics simulations we show that a one-component system can be driven
to a three-dimensional decagonal (10-fold) quasicrystalline state just by purely repulsive …

We evaluate the thermodynamic curvature R for fluid argon, hydrogen, carbon dioxide, and
water. For these fluids, R is mostly negative, but we also find significant regimes of positive …

The state of matter above the critical point is terra incognita, and is loosely discussed as a
physically homogeneous flowing state where no differences can be made between a liquid …

Decades of molecular simulation history proved that the Green-Kubo method for shear
viscosity converges without any problems in atomic and simple molecular liquids, unlike …

Direct measurement of pressure dependent nonlinear refractive index of CO_2 and Xe in
subcritical and supercritical states are reported. In the vicinity of the ridge (or the Widom …

Binary Cu–Zr system is a representative bulk glassformer demonstrating high glass-forming
ability (GFA). From the first glance, the Ni–Zr system is the most natural object to expect the …