相关论文: One-dimensionally confined ammonia molecules: A th…

Despite the fact that by now one dimensional and three dimensional systems of interacting particles are reasonably well understood, very little is known on how to go from the one dimensional physics to the three dimensional one. This is in…

Adsorption properties of several gases (Ne, CH4, Ar, Xe) on the external surface of a carbon nanotube bundle are investigated. Calculations are performed at low coverage and variable temperature, and for some temperatures as a function of…

Intermolecular correlations in liquid acetonitrile (CH3CN) have been revisited by calculating orientational correlation functions. In the present approach, hydrogen atoms are included, so that a concept applicable for molecules of (nearly)…

Fluid phase equilibria involving nano-dispersed phases, where at least one of the coexisting phases is confined to a small volume, are investigated by molecular dynamics simulation. Complementing previous studies on nanoscopic droplets,…

In the present work we discuss based on extensive fully atomistic molecular dynamics simulations the dynamics of Neon atoms oscillating inside (5,5)single-walled carbon nanotubes (CNTs) and boron-nitride (BNNT) ones. Our results show that…

The positions of atoms forming a carbon nanotube are usually described by using a system of generators of the symmetry group. Each atomic position corresponds to an element of the set Z X {0,1,...,n} X {0,1}, where n is a natural number…

We study polar molecules in a stack of strongly confined pancake traps. When dipolar moments point perpendicular to the planes of the traps and are sufficiently strong, the system is stable against collapse but attractive interaction…

We study the change of the size and structure of freely suspended single lamella nanoparticles of polyethylene during thermal annealing in aqueous solutions. Using small-angle x-ray scattering and cryogenic transmission electron microscopy,…

We investigate the coupling of a nanomechanical oscillator in the quantum regime with molecular (electric) dipoles. We find theoretically that the cantilever can produce single-mode squeezing of the center-of-mass motion of an isolated…

Nonchiral single wall carbon nanotubes with an "armchair" wrapping are theoretically predicted to be conducting, and high purity samples consisting predominantly of these tubes exhibit metallic behavior with an intrinsic resistivity which…

We study numerically nonlinear dynamics of several types of molecular systems composed of hydrogen-bonded chains placed inside carbon nanotubes with open edges. We demonstrate that carbon nanotubes provide a stabilization mechanism for…

We calculate the conductance variation of several metallic carbon nanotubes as their end is being dipped into a liquid metal electrode, where experiments have shown an achievable conductance close to 1 quantum of conductance. The calculated…

Persistent currents in rings constructed from carbon nanotubes are investigated theoretically. After studying the contribution of finite temperature or quenched disorder on covalent rings, the complexity due to the bundle packing is…

The optical conductivities of two one-dimensional narrow-gap semiconductors, anticrossing quantum Hall edge states and carbon nanotubes, are studied using bosonization method. A lowest order renormalization group analysis indicates that the…

The influence of the electron-vibron coupling on the transport properties of a strongly interacting quantum dot built in a suspended carbon nanotube is analyzed. The latter is probed by a charged AFM tip scanned along the axis of the CNT…

The spin of a single electron in a suspended carbon nanotube can be read out by using its coupling to the nano-mechanical motion of the nanotube. To show this, we consider a single electron confined within a quantum dot formed by the…

The aim of the paper is the study of fluid mixtures in nanotubes by the methods of continuum mechanics. The model starts from a statistical distribution in mean-field molecular theory and uses a density expansion of Taylor series. We get a…

We describe calculations of the properties of quantum fluids inside nanotubes of various sizes. Very small radius ($R$) pores confine the gases to a line, so that a one-dimensional (1D) approximation is applicable; the low temperature…

Density functional methods have been used to calculate the electronic properties of aligned smalldiameter single-walled carbon nanotubes under hydrostatic pressures. Abrupt pressure induced semiconductor-metal and metal-semiconductor…

We calculate the plasma excitations in a bundle as well as a two-dimensional (2D) periodic array of aligned parallel multishell nanotubes on a substrate. The carbon nanotubes are oriented perpendicular to the substrate. The model we use for…