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Title: Adsorption and Capillary Condensation-Induced Imbibition in Nanoporous Media

Abstract

Multiphase flow phenomena in nanoporous media are encountered in many science and engineering applications. Shales, for example, possessing complex nanopore networks, have considerable importance as source rocks for unconventional oil and gas production and as low-permeability seals for geologic carbon sequestration or nuclear waste disposal. This work presents a theoretical investigation of the processes controlling adsorption, capillary condensation, and imbibition in such nanoporous media, with a particular focus on understanding the effects of fluid-fluid and fluid-pore wall interaction forces in the interconnected nanopore space. Building on a new theoretical framework, we developed a numerical model for the multiphase nanoporous flow and tested it against water vapor uptake measurements conducted on a shale core sample. The model, which is based on the density functional approach, explicitly includes the relevant interaction forces among fluids and solids while allowing for a continuum representation of the porous medium. The experimental data include gravimetrically measured mass changes in an initially dry core sample exposed to varying levels of relative humidity, starting with a low relative humidity (rh = 0.31) followed by a period of a higher relative humidity (rh = 0.81). During this process, water vapor uptake in the dry core is recorded as amore » function of time. Our model suggests that, under low rh conditions, the flow within the shale sample is controlled by adsorption- and diffusion-type processes. After increasing the rh to 0.81, the uptake of water vapor becomes more significant, and according to our model, this can be explained by capillary condensation followed by immiscible displacement in the core sample. It appears that strong fluid-pore wall attractive forces cause condensation near the inlet, which then induces water imbibition further into sample.« less

Authors:
ORCiD logo [1]; ORCiD logo [1];  [1]
  1. Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
Publication Date:
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Fossil Energy (FE)
OSTI Identifier:
1581350
Grant/Contract Number:  
AC02-05CH11231; FWP-ESD14085
Resource Type:
Accepted Manuscript
Journal Name:
Langmuir
Additional Journal Information:
Journal Volume: 35; Journal Issue: 29; Journal ID: ISSN 0743-7463
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
58 GEOSCIENCES; transport properties; diffusion; fluids; shale permeability

Citation Formats

Cihan, Abdullah, Tokunaga, Tetsu K., and Birkholzer, Jens T. Adsorption and Capillary Condensation-Induced Imbibition in Nanoporous Media. United States: N. p., 2019. Web. doi:10.1021/acs.langmuir.9b00813.
Cihan, Abdullah, Tokunaga, Tetsu K., & Birkholzer, Jens T. Adsorption and Capillary Condensation-Induced Imbibition in Nanoporous Media. United States. https://doi.org/10.1021/acs.langmuir.9b00813
Cihan, Abdullah, Tokunaga, Tetsu K., and Birkholzer, Jens T. Wed . "Adsorption and Capillary Condensation-Induced Imbibition in Nanoporous Media". United States. https://doi.org/10.1021/acs.langmuir.9b00813. https://www.osti.gov/servlets/purl/1581350.
@article{osti_1581350,
title = {Adsorption and Capillary Condensation-Induced Imbibition in Nanoporous Media},
author = {Cihan, Abdullah and Tokunaga, Tetsu K. and Birkholzer, Jens T.},
abstractNote = {Multiphase flow phenomena in nanoporous media are encountered in many science and engineering applications. Shales, for example, possessing complex nanopore networks, have considerable importance as source rocks for unconventional oil and gas production and as low-permeability seals for geologic carbon sequestration or nuclear waste disposal. This work presents a theoretical investigation of the processes controlling adsorption, capillary condensation, and imbibition in such nanoporous media, with a particular focus on understanding the effects of fluid-fluid and fluid-pore wall interaction forces in the interconnected nanopore space. Building on a new theoretical framework, we developed a numerical model for the multiphase nanoporous flow and tested it against water vapor uptake measurements conducted on a shale core sample. The model, which is based on the density functional approach, explicitly includes the relevant interaction forces among fluids and solids while allowing for a continuum representation of the porous medium. The experimental data include gravimetrically measured mass changes in an initially dry core sample exposed to varying levels of relative humidity, starting with a low relative humidity (rh = 0.31) followed by a period of a higher relative humidity (rh = 0.81). During this process, water vapor uptake in the dry core is recorded as a function of time. Our model suggests that, under low rh conditions, the flow within the shale sample is controlled by adsorption- and diffusion-type processes. After increasing the rh to 0.81, the uptake of water vapor becomes more significant, and according to our model, this can be explained by capillary condensation followed by immiscible displacement in the core sample. It appears that strong fluid-pore wall attractive forces cause condensation near the inlet, which then induces water imbibition further into sample.},
doi = {10.1021/acs.langmuir.9b00813},
journal = {Langmuir},
number = 29,
volume = 35,
place = {United States},
year = {Wed Jun 26 00:00:00 EDT 2019},
month = {Wed Jun 26 00:00:00 EDT 2019}
}

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Cited by: 14 works
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Figures / Tables:

Table 1 Table 1: Measured or Calculated Model Input Parameters (T = 50 °C)

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Works referenced in this record:

Subcontinuum mass transport of condensed hydrocarbons in nanoporous media
journal, April 2015

  • Falk, Kerstin; Coasne, Benoit; Pellenq, Roland
  • Nature Communications, Vol. 6, Issue 1
  • DOI: 10.1038/ncomms7949

A critical review of water uptake by shales
journal, August 2016


Phase separation in confined systems
journal, December 1999


Roles of gas in capillary filling of nanoslits
journal, January 2012

  • Chauvet, Fabien; Geoffroy, Sandrine; Hamoumi, Abdelkrim
  • Soft Matter, Vol. 8, Issue 41
  • DOI: 10.1039/c2sm25982f

A nanopore machine promotes the vectorial transport of DNA across membranes
journal, September 2013

  • Franceschini, Lorenzo; Soskine, Misha; Biesemans, Annemie
  • Nature Communications, Vol. 4, Issue 1
  • DOI: 10.1038/ncomms3415

The Physicochemical Hydrodynamics of Vascular Plants
journal, January 2014


A review on capillary condensation in nanoporous media: Implications for hydrocarbon recovery from tight reservoirs
journal, November 2016


Thermodynamics of confined nano-phases
journal, July 2014

  • Gubbins, Keith E.; Long, Yun; Śliwinska-Bartkowiak, Małgorzata
  • The Journal of Chemical Thermodynamics, Vol. 74
  • DOI: 10.1016/j.jct.2014.01.024

Viscosity and Wetting Property of Water Confined in Extended Nanospace Simultaneously Measured from Highly-Pressurized Meniscus Motion
journal, August 2012

  • Li, Lixiao; Kazoe, Yutaka; Mawatari, Kazuma
  • The Journal of Physical Chemistry Letters, Vol. 3, Issue 17
  • DOI: 10.1021/jz3009198

What Happens to Permeability at the Nanoscale? A Molecular Dynamics Simulation Study
conference, January 2017

  • Velasco, Raul; Pathak, Manas; Panja, Palash
  • Proceedings of the 5th Unconventional Resources Technology Conference
  • DOI: 10.15530/URTEC-2017-2697415

Local diffusion coefficient measurements in shale using dynamic micro-computed tomography
journal, November 2017


Mesoscale structure, mechanics, and transport properties of source rocks’ organic pore networks
journal, November 2018

  • Berthonneau, Jeremie; Obliger, Amaël; Valdenaire, Pierre-Louis
  • Proceedings of the National Academy of Sciences, Vol. 115, Issue 49
  • DOI: 10.1073/pnas.1808402115

Imbibition and Water Blockage In Unconventional Reservoirs: Well-Management Implications During Flowback and Early Production
journal, November 2014

  • Bertoncello, Antoine; Wallace, Jon; Blyton, Chris
  • SPE Reservoir Evaluation & Engineering, Vol. 17, Issue 04
  • DOI: 10.2118/167698-PA

Imbibition Triggered by Capillary Condensation in Nanopores
journal, February 2017


Capillary Condensation in 8 nm Deep Channels
journal, January 2018

  • Zhong, Junjie; Riordon, Jason; Zandavi, Seyed Hadi
  • The Journal of Physical Chemistry Letters, Vol. 9, Issue 3
  • DOI: 10.1021/acs.jpclett.7b03003

Liquid Intake of Organic Shales
journal, August 2012

  • Dehghanpour, H.; Zubair, H. A.; Chhabra, A.
  • Energy & Fuels, Vol. 26, Issue 9
  • DOI: 10.1021/ef3009794

Image-based micro-continuum model for gas flow in organic-rich shale rock
journal, December 2018


Microstructural imaging and characterization of oil shale before and after pyrolysis
journal, June 2017


Exploring Ultimate Water Capillary Evaporation in Nanoscale Conduits
journal, July 2017


Thermodynamische Theorie der Kapillarität unter Voraussetzung stetiger Dichteänderung
journal, January 1894


Free Energy of a Nonuniform System. I. Interfacial Free Energy
journal, February 1958

  • Cahn, John W.; Hilliard, John E.
  • The Journal of Chemical Physics, Vol. 28, Issue 2
  • DOI: 10.1063/1.1744102

Inhomogeneous Electron Gas
journal, November 1964


Fluids adsorbed in narrow pores: phase equilibria and structure
journal, November 1990


A hydrodynamic description of a multicomponent multiphase mixture in narrow pores and thin layer
journal, January 1995


Modeling of Pore-Scale Two-Phase Phenomena Using Density Functional Hydrodynamics
journal, March 2016


Modeling of nanoscale liquid mixture transport by density functional hydrodynamics
journal, June 2017


Pore-scale modeling of phase change in porous media
journal, August 2018


A phase field model of unsaturated flow: A PHASE FIELD MODEL
journal, October 2009

  • Cueto-Felgueroso, L.; Juanes, R.
  • Water Resources Research, Vol. 45, Issue 10
  • DOI: 10.1029/2009WR007945

Molecular theory of surface tension
journal, May 1976

  • Yang, Arthur J. M.; Fleming, Paul D.; Gibbs, Julian H.
  • The Journal of Chemical Physics, Vol. 64, Issue 9
  • DOI: 10.1063/1.432687

The Maxwell-Stefan approach to mass transfer
journal, March 1997


Diffusion in Binary Solutions. Variation of Diffusion Coefficient with Composition
journal, May 1966

  • Vignes, Alain
  • Industrial & Engineering Chemistry Fundamentals, Vol. 5, Issue 2
  • DOI: 10.1021/i160018a007

The diffusion coefficients of ten slightly soluble gases in water at 10–60°C
journal, November 1966


Capillary Condensation: A Molecular Simulation Study
journal, February 1989


Modeling of Adsorption and Desorption in Pores of Simple Geometry Using Molecular Dynamics
journal, November 2001


Humidity fixed points of binary saturated aqueous solutions
journal, January 1977

  • Greenspan, Lewis
  • Journal of Research of the National Bureau of Standards Section A: Physics and Chemistry, Vol. 81A, Issue 1
  • DOI: 10.6028/jres.081A.011

On the representative elementary volumes of clay rocks at the mesoscale [English]
journal, June 2015


The representative sample size in shale oil rocks and nano-scale characterization of transport properties
journal, July 2015


Pyrite oxidation in moist air
journal, February 2004


Experimental and Theoretical Modeling of Expansion in Pyritic Shale
journal, January 2015

  • Hoover, Shad E.; Greenawalt, Whitney; Tittmann, Brian
  • Geotechnical Testing Journal, Vol. 38, Issue 2
  • DOI: 10.1520/GTJ20130197

Optimal well placement and brine extraction for pressure management during CO2 sequestration
journal, November 2015

  • Cihan, Abdullah; Birkholzer, Jens T.; Bianchi, Marco
  • International Journal of Greenhouse Gas Control, Vol. 42
  • DOI: 10.1016/j.ijggc.2015.07.025

How permeable are clays and shales?
journal, February 1994


Water Adsorption Microcalorimetry Model: Deciphering Surface Energies and Water Chemical Potentials of Nanocrystalline Oxides
journal, May 2014

  • Drazin, John W.; Castro, Ricardo H. R.
  • The Journal of Physical Chemistry C, Vol. 118, Issue 19
  • DOI: 10.1021/jp5016356

Diffusivity of rocks: Gas diffusion measurements and correlation to porosity and pore size distribution: GAS DIFFUSION AND ROCK POROSITY AND PORE SIZE
journal, February 2012

  • Peng, Sheng; Hu, Qinhong; Hamamoto, Shoichiro
  • Water Resources Research, Vol. 48, Issue 2
  • DOI: 10.1029/2011WR011098

Works referencing / citing this record: