Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture: Original Research Article: Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture
Abstract
Abstract In this paper we aim to develop a validated device‐scale CFD model that can predict quantitatively both hydrodynamics and CO 2 capture efficiency for an amine‐based solvent absorber column with random Pall ring packing. A Eulerian porous‐media approach and a two‐fluid model were employed, in which the momentum and mass transfer equations were closed by literature‐based empirical closure models. We proposed a hierarchical approach for calibrating the parameters in the closure models to make them accurate for the packed column. Specifically, a parameter for momentum transfer in the closure was first calibrated based on data from a single experiment. With this calibrated parameter, a parameter in the closure for mass transfer was next calibrated under a single operating condition. Last, the closure of the wetting area was calibrated for each gas velocity at three different liquid flow rates. For each calibration, cross validations were pursued using the experimental data under operating conditions different from those used for calibrations. This hierarchical approach can be generally applied to develop validated device‐scale CFD models for different absorption columns. © 2018 Society of Chemical Industry and John Wiley & Sons, Ltd.
- Authors:
-
- Univ. of Wisconsin, Madison, WI (United States)
- National Energy Technology Lab. (NETL), Morgantown, WV (United States)
- Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
- Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
- Univ. of Kentucky, Lexington, KY (United States). Center for Applied Energy Research (CAER)
- Publication Date:
- Research Org.:
- Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1435290
- Alternate Identifier(s):
- OSTI ID: 1429539
- Grant/Contract Number:
- AC05-00OR22725
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Greenhouse Gases: Science and Technology
- Additional Journal Information:
- Journal Volume: 8; Journal Issue: 3; Journal ID: ISSN 2152-3878
- Publisher:
- Society of Chemical Industry, Wiley
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Citation Formats
Pan, Wenxiao, Galvin, Janine, Huang, Wei Ling, Xu, Zhijie, Sun, Xin, Fan, Zhen, and Liu, Kunlei. Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture: Original Research Article: Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture. United States: N. p., 2018.
Web. doi:10.1002/ghg.1770.
Pan, Wenxiao, Galvin, Janine, Huang, Wei Ling, Xu, Zhijie, Sun, Xin, Fan, Zhen, & Liu, Kunlei. Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture: Original Research Article: Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture. United States. https://doi.org/10.1002/ghg.1770
Pan, Wenxiao, Galvin, Janine, Huang, Wei Ling, Xu, Zhijie, Sun, Xin, Fan, Zhen, and Liu, Kunlei. Sun .
"Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture: Original Research Article: Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture". United States. https://doi.org/10.1002/ghg.1770. https://www.osti.gov/servlets/purl/1435290.
@article{osti_1435290,
title = {Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture: Original Research Article: Device-scale CFD modeling of gas-liquid multiphase flow and amine absorption for CO2 capture},
author = {Pan, Wenxiao and Galvin, Janine and Huang, Wei Ling and Xu, Zhijie and Sun, Xin and Fan, Zhen and Liu, Kunlei},
abstractNote = {Abstract In this paper we aim to develop a validated device‐scale CFD model that can predict quantitatively both hydrodynamics and CO 2 capture efficiency for an amine‐based solvent absorber column with random Pall ring packing. A Eulerian porous‐media approach and a two‐fluid model were employed, in which the momentum and mass transfer equations were closed by literature‐based empirical closure models. We proposed a hierarchical approach for calibrating the parameters in the closure models to make them accurate for the packed column. Specifically, a parameter for momentum transfer in the closure was first calibrated based on data from a single experiment. With this calibrated parameter, a parameter in the closure for mass transfer was next calibrated under a single operating condition. Last, the closure of the wetting area was calibrated for each gas velocity at three different liquid flow rates. For each calibration, cross validations were pursued using the experimental data under operating conditions different from those used for calibrations. This hierarchical approach can be generally applied to develop validated device‐scale CFD models for different absorption columns. © 2018 Society of Chemical Industry and John Wiley & Sons, Ltd.},
doi = {10.1002/ghg.1770},
journal = {Greenhouse Gases: Science and Technology},
number = 3,
volume = 8,
place = {United States},
year = {Sun Mar 25 00:00:00 EDT 2018},
month = {Sun Mar 25 00:00:00 EDT 2018}
}
Web of Science
Figures / Tables:
Works referenced in this record:
CFD Modelling of CO2 Capture in a Packed Bed by Chemical Absorption
journal, June 2013
- Asendrych, Dariusz; Niegodajew, Paweł; Drobniak, Stanisław
- Chemical and Process Engineering, Vol. 34, Issue 2
A hydrodynamic model for two-phase flow through porous media
journal, January 1988
- Tung, V. X.; Dhir, V. K.
- International Journal of Multiphase Flow, Vol. 14, Issue 1
Review of Mass-Transfer Correlations for Packed Columns*
journal, November 2005
- Wang, G. Q.; Yuan, X. G.; Yu, K. T.
- Industrial & Engineering Chemistry Research, Vol. 44, Issue 23
Hydrodynamics of Trickle-Bed Reactors: Experiments and CFD Modeling
journal, August 2005
- Gunjal, Prashant R.; Kashid, Madhavanand N.; Ranade, Vivek V.
- Industrial & Engineering Chemistry Research, Vol. 44, Issue 16
Absorber model for CO2 capture by monoethanolamine — application to CASTOR pilot results
journal, February 2009
- Dugas, Ross; Alix, Pascal; Lemaire, Eric
- Energy Procedia, Vol. 1, Issue 1
Constitutive equation for heat transfer caused by mass transfer
journal, February 2015
- Musser, Jordan; Syamlal, Madhava; Shahnam, Mehrdad
- Chemical Engineering Science, Vol. 123
Modelling of the hydrodynamics of the cocurrent gas–liquid trickle flow through a trickle-bed reactor
journal, March 1999
- Attou, A.; Boyer, C.; Ferschneider, G.
- Chemical Engineering Science, Vol. 54, Issue 6
Liquid spreading in trickle-bed reactors: Experiments and numerical simulations using Eulerian--Eulerian two-fluid approach
text, January 2015
- Solomenko, Z.; Haroun, Yacine; Fourati, Manel
- arXiv
hydrodynamic parameters for gas-liquid cocurrent flow in packed beds
journal, January 1985
- Sáez, A. E.; Carbonell, R. G.
- AIChE Journal, Vol. 31, Issue 1
The generalized slit model: Pressure gradient, liquid holdup & wetting efficiency in gas–liquid trickle flow
journal, November 1999
- Iliuta, Ion; Larachi, Faı̈çal
- Chemical Engineering Science, Vol. 54, Issue 21
Characteristics of liquid and tracer dispersion in trickle-bed reactors: Effect on CFD modeling and experimental analyses
journal, January 2011
- Lappalainen, Katja; Gorshkova, Elena; Manninen, Mikko
- Computers & Chemical Engineering, Vol. 35, Issue 1
The effect of fly ash on fluid dynamics of CO2 scrubber in coal-fired power plant
journal, March 2012
- Chen, Zhisheng; Yates, Derek; Neathery, James K.
- Chemical Engineering Research and Design, Vol. 90, Issue 3
Kinetics of the reactive absorption of carbon dioxide in high CO2-loaded, concentrated aqueous monoethanolamine solutions
journal, December 2003
- Aboudheir, Ahmed; Tontiwachwuthikul, Paitoon; Chakma, Amit
- Chemical Engineering Science, Vol. 58, Issue 23-24
Surface Tension of Binary Mixtures of Water + Monoethanolamine and Water + 2-Amino-2-methyl-1-propanol and Tertiary Mixtures of These Amines with Water from 25 °C to 50 °C
journal, January 1997
- Vázquez, Gonzalo; Alvarez, Estrella; Navaza, José M.
- Journal of Chemical & Engineering Data, Vol. 42, Issue 1
Gas−liquid multiphase computational fluid dynamics (CFD) of amine absorption column with structured-packing for CO2 capture
journal, May 2016
- Kim, Jeongeun; Pham, Dung A.; Lim, Young-Il
- Computers & Chemical Engineering, Vol. 88
CFD modeling of radial spreading of flow in trickle-bed reactors due to mechanical and capillary dispersion
journal, January 2009
- Lappalainen, Katja; Manninen, Mikko; Alopaeus, Ville
- Chemical Engineering Science, Vol. 64, Issue 2
Hierarchical calibration and validation framework of bench-scale computational fluid dynamics simulations for solvent-based carbon capture. Part 2: Chemical absorption across a wetted wall column: Original Research Article: Hierarchical calibration and validation framework of bench-scale computational fluid dynamics simulations
journal, October 2017
- Wang, Chao; Xu, Zhijie; Lai, Kevin
- Greenhouse Gases: Science and Technology, Vol. 8, Issue 1
Liquid dispersion in packed columns: Experiments and numerical modeling
journal, August 2013
- Fourati, M.; Roig, V.; Raynal, L.
- Chemical Engineering Science, Vol. 100
Hydrodynamic continuum model for two-phase flow structured-packing-containing columns
journal, February 2004
- Iliuta, I.; Petre, C. F.; Larachi, F.
- Chemical Engineering Science, Vol. 59, Issue 4
Mass Transfer Coefficients Between gas and Liquid Phases in Packed Columns
journal, January 1968
- Onda, Kakusaburo; Takeuchi, Hiroshi; Okumoto, Yoshio
- Journal of Chemical Engineering of Japan, Vol. 1, Issue 1
Density and Viscosity of Some Partially Carbonated Aqueous Alkanolamine Solutions and Their Blends
journal, May 1998
- Weiland, Ralph H.; Dingman, John C.; Cronin, D. Benjamin
- Journal of Chemical & Engineering Data, Vol. 43, Issue 3
Multiphase catalytic reactors: a perspective on current knowledge and future trends
journal, August 2002
- Duduković, Milorad P.; Larachi, Faical; Mills, Patrick L.
- Catalysis Reviews, Vol. 44, Issue 1
Onset of pulsing in two-phase cocurrent downflow through a packed bed
journal, November 1988
- Grosser, K.; Carbonell, R. G.; Sundaresan, S.
- AIChE Journal, Vol. 34, Issue 11
Review of design correlations for CO2 absorption into MEA using structured packings
journal, July 2012
- Razi, Neda; Bolland, Olav; Svendsen, Hallvard
- International Journal of Greenhouse Gas Control, Vol. 9
Use of CFD for CO2 absorbers optimum design : from local scale to large industrial scale
journal, February 2009
- Raynal, L.; Ben Rayana, F.; Royon-Lebeaud, A.
- Energy Procedia, Vol. 1, Issue 1
LII. The viscosity of gases and molecular force
journal, December 1893
- Sutherland, William
- The London, Edinburgh, and Dublin Philosophical Magazine and Journal of Science, Vol. 36, Issue 223
A Model for Estimating CO 2 Solubility in Aqueous Alkanolamines
journal, April 2005
- Gabrielsen, Jostein; Michelsen, Michael L.; Stenby, Erling H.
- Industrial & Engineering Chemistry Research, Vol. 44, Issue 9
Liquid spreading in trickle-bed reactors: Experiments and numerical simulations using Eulerian–Eulerian two-fluid approach
journal, April 2015
- Solomenko, Z.; Haroun, Y.; Fourati, M.
- Chemical Engineering Science, Vol. 126
A dimensionless model for predicting the mass-transfer area of structured packing
journal, June 2010
- Tsai, Robert E.; Seibert, A. Frank; Eldridge, R. Bruce
- AIChE Journal, Vol. 57, Issue 5
CFD of multiphase flow in packed-bed reactors: II. Results and applications
journal, April 2002
- Jiang, Y.; Khadilkar, M. R.; Al-Dahhan, M. H.
- AIChE Journal, Vol. 48, Issue 4
Porous media Eulerian computational fluid dynamics (CFD) model of amine absorber with structured-packing for CO2 removal
journal, August 2015
- Pham, Dung A.; Lim, Young-Il; Jee, Hyunwoo
- Chemical Engineering Science, Vol. 132
CFD of multiphase flow in packed-bed reactors: I.k-Fluid modeling issues
journal, April 2002
- Jiang, Y.; Khadilkar, M. R.; Al-Dahhan, M. H.
- AIChE Journal, Vol. 48, Issue 4
Modeling of laboratory and commercial scale hydro-processing reactors using CFD
journal, September 2007
- Gunjal, Prashant R.; Ranade, Vivek V.
- Chemical Engineering Science, Vol. 62, Issue 18-20
Computational Modeling of Trickle Bed Reactors
journal, September 2011
- Kuzeljevic, Zeljko V.; Dudukovic, Milorad P.
- Industrial & Engineering Chemistry Research, Vol. 51, Issue 4
Post combustion CO2 capture by reactive absorption: Pilot plant description and results of systematic studies with MEA
journal, January 2012
- Notz, Ralf; Mangalapally, Hari Prasad; Hasse, Hans
- International Journal of Greenhouse Gas Control, Vol. 6
Calibration of drag models for mesoscale simulation of gas–liquid flow through packed beds
journal, November 2017
- Finn, Justin R.; Galvin, Janine E.
- Chemical Engineering Science, Vol. 172
Three-dimensional simulation of rivulet and film flows over an inclined plate: Effects of solvent properties and contact angle
journal, March 2016
- Singh, Rajesh K.; Galvin, Janine E.; Sun, Xin
- Chemical Engineering Science, Vol. 142
Adiabatic gas Absorption and Stripping with Chemical Reaction in Packed Towers
journal, January 1983
- Pandya, J. D.
- Chemical Engineering Communications, Vol. 19, Issue 4-6
Solubility and diffusivity of acid gases (carbon dioxide, nitrous oxide) in aqueous alkanolamine solutions
journal, January 1988
- Versteeg, Geert F.; Van Swaaij, Wim P. M.
- Journal of Chemical & Engineering Data, Vol. 33, Issue 1
New Method for Prediction of Binary Gas-Phase Diffusion Coefficients
journal, May 1966
- Fuller, Edward N.; Schettler, Paul D.; Giddings, J. Calvin.
- Industrial & Engineering Chemistry, Vol. 58, Issue 5
Model Building Methodology for Multiphase Reaction Systems—Modeling of CO 2 Absorption in Monoethanolamine for Laminar Jet Absorbers and Packing Beds
journal, March 2012
- Hiwale, Rameshwar; Hwang, Sungwon; Smith, Robin
- Industrial & Engineering Chemistry Research, Vol. 51, Issue 11
Modelling reactive absorption of CO2 in packed columns for post-combustion carbon capture applications
journal, September 2011
- Khan, F. M.; Krishnamoorthi, V.; Mahmud, T.
- Chemical Engineering Research and Design, Vol. 89, Issue 9
Mass transfer and kinetics of carbon dioxide absorption into loaded aqueous monoethanolamine solutions
journal, February 2015
- Luo, Xiao; Hartono, Ardi; Hussain, Saddam
- Chemical Engineering Science, Vol. 123
Computational Fluid Dynamics Simulation of Structured Packing
journal, January 2013
- Owens, Scott A.; Perkins, Michael R.; Eldridge, R. Bruce
- Industrial & Engineering Chemistry Research, Vol. 52, Issue 5
The kinetics of reactions of carbon dioxide with monoethanolamine, diethanolamine and triethanolamine by a rapid mixing method
journal, January 1977
- Hikita, H.; Asai, S.; Ishikawa, H.
- The Chemical Engineering Journal, Vol. 13, Issue 1
A phenomenological model for pressure drop, liquid holdup, and flow regime transition in gas-liquid trickle flow
journal, June 1992
- Holub, R. A.; Duduković, M. P.; Ramachandran, P. A.
- Chemical Engineering Science, Vol. 47, Issue 9-11
Breakup of a liquid rivulet falling over an inclined plate: Identification of a critical Weber number
journal, May 2017
- Singh, Rajesh K.; Galvin, Janine E.; Whyatt, Greg A.
- Physics of Fluids, Vol. 29, Issue 5
Chemical Reaction Engineering
journal, November 1999
- Levenspiel, Octave
- Industrial & Engineering Chemistry Research, Vol. 38, Issue 11