Van der Waals materials have received a great deal of attention for their exceptional layered structures and exotic properties, which can open up various device applications in nanoelectronics. However, in situ epitaxial growth of dissimilar van der Waals materials remains challenging. Here we demonstrate a solution for fabricating van der Waals heterostructures. Graphene/hexagonal boron nitrid...

Here we apply the two-dimensional van der Waals model to interpret surface-tension isotherms of aqueous solutions of n-alkanoic (fatty) acids. We processed available experimental data for a homologous series of eight acids, from pentanoic to dodecanoic (lauric). Only three adjustable parameters have been varied to fit simultaneously all experimental curves. Excellent agreement between the theor...

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...

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 internal structure of a molecule can be presented in terms of intra-molecular (i.e., inter atomic)and inter-molecular energies such as van der waals, bond and bending, torsion, and inversion energy.in this study, changes in molecular energies of individual asphalt components are evaluated as afunction of physical aging factors. the factors for physical aging such as temperature and pressure...

In this article, we are interested in the simulation of phase transition in compressible flows, with the isothermal Euler system, closed by the van-der-Waals model. We formulate the problem as an hyperbolic system, with a source term located at the interface between liquid and vapour. The numerical scheme is based on [1, 5]. Compared with previous discretizations of the van-der-Waals system, th...

The bonding situation in mercury-alkali diatomics HgA ((2)Sigma(+)) (A = Li, Na, K, Rb) has been investigated employing the relativistic all-electron method Normalized Elimination of the Small Component (NESC), CCSD(T), and augmented VTZ basis sets. Although Hg,A interactions are typical of van der Waals complexes, trends in calculated D(e) values can be explained on the basis of a 3-electron 2...

We have computed the entropy of liquid water using a two-phase thermodynamic model and trajectories generated by ab initio molecular dynamics simulations. We present the results obtained with semilocal, hybrid, and van der Waals density functionals. We show that in all cases, at the experimental equilibrium density and at temperatures in the vicinity of 300 K, the computed entropies are underes...