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...

We use scanning tunneling microscopy to visualize and thermal desorption spectroscopy to quantitatively measure that the binding of naphthalene molecules to graphene, a case of pure van der Waals interaction, strengthens with n and weakens with p doping of graphene. Density-functional theory calculations that include the van der Waals interaction in a seamless, ab initio way accurately reproduc...

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...

Abstract The accurate calculations of adsorption equilibrium for multicomponent gas systems are of great importance in many applications. In this paper, five two-dimensional equations of state 2D-EOS, i.e. Van der Waals, Eyring, Zhou-Ghasem-Robinson, Soave-Redlich-Kwong and Peng-Robinson, were examined to find out their abilities to predict adsorption equilibrium for pure and multi-component ga...

The density-density plot of the critical lines of the van der Waats equation at the van Laar point is analyzed through its algebraic properties. It is shown that this curve is an irreducible expression of the fifth degree of genus one. In addition, we show the topology of the second branch, i.e., the T= 0 solution, which will interact with the first branch as soon as the energy parameters are s...

Dynamic rheological techniques are used to probe the microstructures present in fumed silica-based composite polymer electrolytes. These electrolytes are obtained by dispersing hydrophobic fumed silica in a poly(ethylene glycol)-lithium salt solution and display high conductivities (σ298K > 10-3 S/cm), mechanical stability, and easy processability. The materials behave as soft solids (gels) und...

BACKGROUND The prediction of ligand binding or protein structure requires very accurate force field potentials - even small errors in force field potentials can make a 'wrong' structure (from the billions possible) more stable than the single, 'correct' one. However, despite huge efforts to optimize them, currently-used all-atom force fields are still not able, in a vast majority of cases, even...

We investigate the role of weak clamping forces, typically assumed to be infinite, in carbon nanotube mechanical resonators. Due to these forces, we observe a hysteretic clamping and unclamping of the nanotube device that results in a discrete drop in the mechanical resonance frequency on the order of 5-20 MHz, when the temperature is cycled between 340 and 375 K. This instability in the resona...

We have developed a model for the calculation of van der Waals force for layered systems with axial symmetry. Our result can be applied to compute the cohesion of a carbon nanotube to a substrate, the cohesion between nanotubes, and between shells of multiwall nanotubes. We have obtained unusal power laws for the distance dependence of the many-body van der Waals potential.