Tracer counterpermeation analysis of diffusivity in finite-length nanopores with and without single-file dynamics.

نویسندگان

  • David M Ackerman
  • James W Evans
چکیده

We perform a tracer counterpermeation (TCP) analysis for a stochastic model of diffusive transport through a narrow linear pore where passing of species within the pore is inhibited or even excluded (single-file diffusion). TCP involves differently labeled but otherwise identical particles from two decoupled infinite reservoirs adsorbing into opposite ends of the pore, and desorbing from either end. In addition to transient behavior, we assess steady-state concentration profiles, spatial correlations, particle number fluctuations, and diffusion fluxes through the pore. From the profiles and fluxes, we determine a generalized tracer diffusion coefficient D_{tr}(x), at various positions x within the pore. D_{tr}(x) has a plateau value in the pore center scaling inversely with the pore length, but it is enhanced near the pore openings. The latter feature reflects the effect of fluctuations in adsorption and desorption, and it is also associated with a nontrivial scaling of the concentration profiles near the pore openings.

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Geometric Effects on Nanopore Creation in Graphene and on the Impact-withstanding Efficiency of Graphene Nanosheets

Abstract Single- and multilayer graphene sheets (MLGSs) are projectile-resisting materials that can be bombarded by nanoparticles to produce graphene sheets of various sizes and distributions of nanopores. These sheets are used in a variety of applications, including DNA sequencing, water desalination, and phase separation. Here, the impact-withstanding efficiency of graphene nanosheets and the...

متن کامل

Vibration Analysis of Circular Single-Layer Graphene Sheet Using Finite Element Method

Graphene sheets are combined of Honeycombs lattice carbon-carbon bonds which have high natural frequencies, high strength, and high conductivity. Due to important applications of the graphene sheets particularly at higher frequencies, the study of their dynamic behavior is important in this frequency range. From Molecular Dynamics (MD) point of view as the dimensions of graphene sheet incline, ...

متن کامل

Molecular Dynamics Simulation of Water in Single WallCarbon Nanotube

The overall aim of this study is to calculate some water properties in the single wall carbon naotubes (SWCNT) and compare them to the bulk water properties to investigate the deviation of water properties inside the SWCNT from those in the bulk. Here some physical and transport properties of water molecules in the single wall carbon nanotube were reported by performing molecular dynamics (MD) ...

متن کامل

Dynamics Analysis of the Steady and Transient States of a Nonlinear Piezoelectric Beam by a Finite Element Method

This paper presents a finite element formulation for the dynamics analysis of the steady and transient states of a nonlinear piezoelectric beam. A piezoelectric beam with damping is studied under harmonic excitation. A numerical method is used for this analysis. In the paper, the central difference formula of four order is used and compared with the central difference formula of two order in th...

متن کامل

Investigating the Performance of Cracked Asphalt Pavement Using Finite Elements Analysis

Occurrence of top down and bottom up fatigue cracking in asphaltic pavements is common. Conventional pavement analysis methods ignore the existence of cracks in asphaltic layers. However, it seems that the responses of cracked pavement would not be the same as a pavement without crack. This paper describes effects of crack type, position and length, and vehicles tire inflation pressure and axle...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

عنوان ژورنال:
  • Physical review. E

دوره 95 1-1  شماره 

صفحات  -

تاریخ انتشار 2017