The complex concentration alloys exhibit the excellent mechanical property due to the dual
roles of their heterogeneous compositions and microstructures. However, the formation and …

We study the interfacial thermal conductance of grain boundaries (GBs) between monolayer
graphene and hexagonal boron nitride (h-BN) sheets using a combined atomistic approach …

Effects of three-point direct correlation on properties of the phase field crystal (PFC)
modeling are examined for the control of various ordered and disordered phases and their …

The dynamical mechanisms underlying the grain evolution and growth are of fundamental
importance in controlling the structural properties of large-scale polycrystalline materials, but …

A phase-field crystal model based on the density-field approach incorporating high-order
interparticle direct correlations is developed to study vapor-liquid-solid coexistence and …

We present a mesoscale field theory unifying the modeling of growth, elasticity, and
dislocations in quasicrystals. The theory is based on the amplitudes entering their density …

The formation energy of an arbitrary graphene edge or that of other 2D materials has been
estimated as a summation of the armchair (AC) and zigzag (ZZ) edge sites. Such an …

In this study, the influence of 5| 7 dislocations in multilayer graphene stacks (up to six layers)
is examined. The study is conducted using a recently developed phase-field crystal (PFC) …

In this paper a systematic examination of graphene/hexagonal boron nitride (g/hBN) bilayers
is presented, through a recently developed two-dimensional phase field crystal model that …

One of the classes of the kinetic phase-field model in the form of the two-mode hyperbolic
phase-field crystal model (modified PFC model) is used for the study of the noise effect of the …