Literature DB >> 26590541

Relation between pore size and the compressibility of a confined fluid.

Gennady Y Gor1, Daniel W Siderius2, Christopher J Rasmussen3, William P Krekelberg2, Vincent K Shen2, Noam Bernstein4.   

Abstract

When a fluid is confined to a nanopore, its thermodynamic properties differ from the properties of a bulk fluid, so measuring such properties of the confined fluid can provide information about the pore sizes. Here, we report a simple relation between the pore size and isothermal compressibility of argon confined in such pores. Compressibility is calculated from the fluctuations of the number of particles in the grand canonical ensemble using two different simulation techniques: conventional grand-canonical Monte Carlo and grand-canonical ensemble transition-matrix Monte Carlo. Our results provide a theoretical framework for extracting the information on the pore sizes of fluid-saturated samples by measuring the compressibility from ultrasonic experiments.

Entities:  

Year:  2015        PMID: 26590541      PMCID: PMC4697274          DOI: 10.1063/1.4935430

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  19 in total

1.  Evaluating surface tension using grand-canonical transition-matrix Monte Carlo simulation and finite-size scaling.

Authors:  Jeffrey R Errington
Journal:  Phys Rev E Stat Nonlin Soft Matter Phys       Date:  2003-01-28

2.  Monte Carlo Simulation Methods for Computing Liquid-Vapor Saturation Properties of Model Systems.

Authors:  Kaustubh S Rane; Sabharish Murali; Jeffrey R Errington
Journal:  J Chem Theory Comput       Date:  2013-05-30       Impact factor: 6.006

3.  Determination of fluid-phase behavior using transition-matrix Monte Carlo: binary Lennard-Jones mixtures.

Authors:  Vincent K Shen; Jeffrey R Errington
Journal:  J Chem Phys       Date:  2005-02-08       Impact factor: 3.488

4.  Prewetting transitions for a model argon on solid carbon dioxide system.

Authors:  Jeffrey R Errington
Journal:  Langmuir       Date:  2004-04-27       Impact factor: 3.882

5.  Determination of surface tension in binary mixtures using transition-matrix Monte Carlo.

Authors:  Vincent K Shen; Jeffrey R Errington
Journal:  J Chem Phys       Date:  2006-01-14       Impact factor: 3.488

6.  Effect of pressure on the freezing of pure fluids and mixtures confined in nanopores.

Authors:  Benoit Coasne; J Czwartos; M Sliwinska-Bartkowiak; Keith E Gubbins
Journal:  J Phys Chem B       Date:  2009-10-22       Impact factor: 2.991

7.  Pressure enhancement in carbon nanopores: a major confinement effect.

Authors:  Yun Long; Jeremy C Palmer; Benoit Coasne; Małgorzata Śliwinska-Bartkowiak; Keith E Gubbins
Journal:  Phys Chem Chem Phys       Date:  2011-08-30       Impact factor: 3.676

8.  Adsorption stress changes the elasticity of liquid argon confined in a nanopore.

Authors:  Gennady Y Gor
Journal:  Langmuir       Date:  2014-11-06       Impact factor: 3.882

9.  Capillary condensation hysteresis in overlapping spherical pores: a Monte Carlo simulation study.

Authors:  Gennady Yu Gor; Christopher J Rasmussen; Alexander V Neimark
Journal:  Langmuir       Date:  2012-08-06       Impact factor: 3.882

10.  Elucidating the effects of adsorbent flexibility on fluid adsorption using simple models and flat-histogram sampling methods.

Authors:  Vincent K Shen; Daniel W Siderius
Journal:  J Chem Phys       Date:  2014-06-28       Impact factor: 3.488

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  5 in total

1.  Quasi-Two-Dimensional Phase Transition of Methane Adsorbed in Cylindrical Silica Mesopores.

Authors:  Daniel W Siderius; William P Krekelberg; Wei-Shan Chiang; Vincent K Shen; Yun Liu
Journal:  Langmuir       Date:  2017-12-11       Impact factor: 3.882

2.  Modulus-pressure equation for confined fluids.

Authors:  Gennady Y Gor; Daniel W Siderius; Vincent K Shen; Noam Bernstein
Journal:  J Chem Phys       Date:  2016-10-28       Impact factor: 3.488

3.  Relationship between Pore-size Distribution and Flexibility of Adsorbent Materials: Statistical Mechanics and Future Material Characterization Techniques.

Authors:  Daniel W Siderius; Nathan A Mahynski; Vincent K Shen
Journal:  Adsorption (Boston)       Date:  2017-03-30       Impact factor: 2.318

4.  Extended hierarchical solvent perturbations from curved surfaces of mesoporous silica particles in a deep eutectic solvent.

Authors:  Joshua A Hammons; Fan Zhang; Jan Ilavsky
Journal:  J Colloid Interface Sci       Date:  2018-03-03       Impact factor: 8.128

5.  The impact of cryosolution thermal contraction on proteins and protein crystals: volumes, conformation and order.

Authors:  Douglas H Juers; Christopher A Farley; Christopher P Saxby; Rosemary A Cotter; Jackson K B Cahn; R Conor Holton-Burke; Kaitlin Harrison; Zhenguo Wu
Journal:  Acta Crystallogr D Struct Biol       Date:  2018-09-05       Impact factor: 7.652

  5 in total

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