In this article, curvature effects on elastic thermal buckling of double-walled carbon nanotubes under axially compressed force are investigated using cylindrical shell model. Also, the small scale effect is taken into account in the formulation. The dependence of the interlayer van der Waals (vdW) pressure on the change of the curvatures of the inner and outer tubes at that point is considered...

The accurate description of van der Waals forces within density functional theory is currently one of the most active areas of research in computational physics and chemistry. Here we report results on the structural and energetic properties of graphite and hexagonal boron nitride, two layered materials where interlayer binding is dominated by van der Waals forces. Results from several density ...

In this paper, we calculate the second virial coefficient for binary mixtures of Ar with CH4 and CO in order to evaluate the performance of equations of state (EOSs). The investigated EOSs are van der Waals (vdW), Redlich-Kwong (RK), Peng-Robinson (PR), Carnahan-Starling–van der Waals (CS-vdW) and Guggenheim-van der Waals (G-vdW) based on van der Waals model. In our work, we also use Dieterici ...

In this article, based on the Euler-Bernoulli beam theory, the large-amplitude vibration of multiwalled carbon nanotubes embedded in an elastic medium is investigated. The method of incremental harmonic balance is implemented to solve the set of governing nonlinear equations coupled via the van der Waals (vdW) interlayer force. The influences of number of tube walls, the elastic medium, nanotub...

The interlayer sliding potential of multilayered hexagonal boron nitride (h-BN) and graphene is investigated using density-functional theory including many-body van der Waals (vdW) interactions. We find that interlayer sliding constraints can be employed to tune the contribution of electrostatic interactions and dispersive forces to the sliding energy profile, ultimately leading to different sl...

Sensitive dependence of the electronic structure on the number of layers in few-layer phosphorene raises a question about the true nature of the interlayer interaction in so-called "van der Waals (vdW) solids". We performed quantum Monte Carlo calculations and found that the interlayer interaction in bulk black phosphorus and related few-layer phosphorene is associated with a significant charge...

the presence of van der waals (vdw) force can lead to mechanical instability in freestanding nano-scale actuators. most of the previous researches in this area have exclusively focused on modeling the instability in actuators with one actuating components. while, less attention has been paid to actuators consist of two actuating components. herein, the effect of the vdw force on the instability...

The Casimir attraction can significantly interfere the physical response of nanoactuators. The intensity of the Casimir force depends on the geometries of interacting bodies. The present paper is dedicated to model the influence of the Casimir attraction on the electrostatic stability of nanoactuators made of cylindrical conductive nanowire/nanotube. An asymptotic solution, based on path-integr...

Stacking two-dimensional (2D) materials into multi-layers or heterostructures, known as van der Waals (vdW) epitaxy, is an essential degree of freedom for tuning their properties on demand. Few-layer black phosphorus (FLBP), a material with high potential for nano- and optoelectronics applications, appears to have interlayer couplings much stronger than graphene and other 2D systems. Indeed, th...

van der Waals (vdW) forces, despite being relatively weak, hold the layers together in transition metal dichalcogenides (TMDs) and play a key role in their band structure evolution, hence profoundly affecting their physical properties. In this work, we experimentally probe the vdW interactions in MoS2 and other TMDs by measuring the valence band maximum (VBM) splitting (Δ) at K point as a funct...