Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems

Lai, King C.; Pleasant, Tyler J.; García, Andrés; Evans, James W.

doi:10.1103/PhysRevE.101.062103

Title: Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems

Authors:

^[1];

^[1]; García, Andrés ^[1];

^[1]

Ames Lab., and Iowa State Univ., Ames, IA (United States)

Publication Date:: Mon Jun 01 00:00:00 EDT 2020

Research Org.:: Ames Lab., Ames, IA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division

OSTI Identifier:: 1633316

Alternate Identifier(s):: OSTI ID: 1633761

Report Number(s):: IS-J-10,242
Journal ID: ISSN 2470-0045; PLEEE8; TRN: US2201178

Grant/Contract Number:: AC02-07CH11358

Resource Type:: Accepted Manuscript

Journal Name:: Physical Review E

Additional Journal Information:: Journal Volume: 101; Journal Issue: 6; Journal ID: ISSN 2470-0045

Publisher:: American Physical Society (APS)

Country of Publication:: United States

Language:: English

Subject:: 71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS; Diffusion; Statistical physics

Citation Formats


                    Lai, King C., Pleasant, Tyler J., García, Andrés, and Evans, James W. Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems.  United States: N. p., 2020. 
Web.  doi:10.1103/PhysRevE.101.062103.

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                    Lai, King C., Pleasant, Tyler J., García, Andrés, & Evans, James W. Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems.  United States.  https://doi.org/10.1103/PhysRevE.101.062103

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                    Lai, King C., Pleasant, Tyler J., García, Andrés, and Evans, James W. Mon .  
"Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems".  United States.  https://doi.org/10.1103/PhysRevE.101.062103.  https://www.osti.gov/servlets/purl/1633316.

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@article{osti_1633316,

  title        = {Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems},

  author       = {Lai, King C. and Pleasant, Tyler J. and García, Andrés and Evans, James W.},

  abstractNote = {},

  doi          = {10.1103/PhysRevE.101.062103},

  journal      = {Physical Review E},

  number       = 6,

  volume       = 101,

  place        = {United States},

  year         = {Mon Jun 01 00:00:00 EDT 2020},

  month        = {Mon Jun 01 00:00:00 EDT 2020}

}

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Title: Generalized hydrodynamic analysis of transport through a finite open nanopore for two-component single-file systems

Citation Formats

New avenues for the large-scale harvesting of blue energy journal, November 2017

Diffusion with “collisions” between particles journal, December 1965

Permeation through long narrow pores journal, July 1963

Mobility, interdiffusion, and tracer diffusion in lattice-gas models of two-component alloys journal, March 1989

From atomistic lattice-gas models for surface reactions to hydrodynamic reaction-diffusion equations journal, March 2002

Single-File Diffusion in a Box journal, May 2008

Large-Scale Computational Screening of Zeolites for Ethane/Ethene Separation journal, August 2012

Tracer counterpermeation analysis of diffusivity in finite-length nanopores with and without single-file dynamics journal, January 2017

Self-diffusion in single-file zeolite membranes is Fickian at long times journal, May 1999

A new theory of transport for cell membrane pores. II. Exact results and computer simulation (molecular dynamics) journal, November 1974

Catalytic conversion reactions in nanoporous systems with concentration-dependent selectivity: Statistical mechanical modeling journal, May 2016

Subdiffusion and Long-Time Anticorrelations in a Stochastic Single File journal, September 2006

Deviations from the Normal Time Regime of Single-File Diffusion journal, July 1998

Tracer Exchange and Catalytic Reaction in Single-File Systems journal, December 1995

A consistent correlation approach to single file diffusion with reaction journal, August 1999

Generalized hydrodynamics journal, January 1984

Distance-voltage characteristics in scanning tunneling microscopy journal, February 1986

Reciprocal Relations in Irreversible Processes. I. journal, February 1931

Diffusion of color in the simple exclusion process journal, July 1992

Diffusion in concentrated lattice gases. III. Tracer diffusion on a one-dimensional lattice journal, November 1983

Control of zeolite framework flexibility and pore topology for separation of ethane and ethylene journal, November 2017

Morphological evolution during epitaxial thin film growth: Formation of 2D islands and 3D mounds journal, April 2006

The potassium permeability of a giant nerve fibre journal, April 1955

Chemical diffusion in the lattice gas of non-interacting particles journal, January 1981

Large Deviations in Single-File Diffusion journal, August 2014

Discovery of optimal zeolites for challenging separations and chemical transformations using predictive materials modeling journal, January 2015

Realistic multisite lattice-gas modeling and KMC simulation of catalytic surface reactions: Kinetics and multiscale spatial behavior for CO-oxidation on metal (100) surfaces journal, December 2013

Modeling tracer counter-permeation through anisotropic zeolite membranes: from mean field theory to single-file diffusion journal, July 1999

Kinetic Monte Carlo Simulation of Statistical Mechanical Models and Coarse-Grained Mesoscale Descriptions of Catalytic Reaction–Diffusion Processes: 1D Nanoporous and 2D Surface Systems journal, April 2015

New avenues for the large-scale harvesting of blue energy
journal, November 2017

Diffusion with “collisions” between particles
journal, December 1965

Permeation through long narrow pores
journal, July 1963

Mobility, interdiffusion, and tracer diffusion in lattice-gas models of two-component alloys
journal, March 1989

From atomistic lattice-gas models for surface reactions to hydrodynamic reaction-diffusion equations
journal, March 2002

Single-File Diffusion in a Box
journal, May 2008

Large-Scale Computational Screening of Zeolites for Ethane/Ethene Separation
journal, August 2012

Tracer counterpermeation analysis of diffusivity in finite-length nanopores with and without single-file dynamics
journal, January 2017

Self-diffusion in single-file zeolite membranes is Fickian at long times
journal, May 1999

A new theory of transport for cell membrane pores. II. Exact results and computer simulation (molecular dynamics)
journal, November 1974

Catalytic conversion reactions in nanoporous systems with concentration-dependent selectivity: Statistical mechanical modeling
journal, May 2016

Subdiffusion and Long-Time Anticorrelations in a Stochastic Single File
journal, September 2006

Deviations from the Normal Time Regime of Single-File Diffusion
journal, July 1998

Tracer Exchange and Catalytic Reaction in Single-File Systems
journal, December 1995

A consistent correlation approach to single file diffusion with reaction
journal, August 1999

Generalized hydrodynamics
journal, January 1984

Distance-voltage characteristics in scanning tunneling microscopy
journal, February 1986

Reciprocal Relations in Irreversible Processes. I.
journal, February 1931

Diffusion of color in the simple exclusion process
journal, July 1992

Diffusion in concentrated lattice gases. III. Tracer diffusion on a one-dimensional lattice
journal, November 1983

Control of zeolite framework flexibility and pore topology for separation of ethane and ethylene
journal, November 2017

Morphological evolution during epitaxial thin film growth: Formation of 2D islands and 3D mounds
journal, April 2006

The potassium permeability of a giant nerve fibre
journal, April 1955

Chemical diffusion in the lattice gas of non-interacting particles
journal, January 1981

Large Deviations in Single-File Diffusion
journal, August 2014

Discovery of optimal zeolites for challenging separations and chemical transformations using predictive materials modeling
journal, January 2015

Realistic multisite lattice-gas modeling and KMC simulation of catalytic surface reactions: Kinetics and multiscale spatial behavior for CO-oxidation on metal (100) surfaces
journal, December 2013

Modeling tracer counter-permeation through anisotropic zeolite membranes: from mean field theory to single-file diffusion
journal, July 1999

Kinetic Monte Carlo Simulation of Statistical Mechanical Models and Coarse-Grained Mesoscale Descriptions of Catalytic Reaction–Diffusion Processes: 1D Nanoporous and 2D Surface Systems
journal, April 2015