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Title: Carbon capture turned upside down: high-temperature adsorption & low-temperature desorption (HALD)

Abstract

Carbon capture & sequestration (CCS) could reduce CO2 emissions from large fossil-fuel power plants on the short term, but the high energy penalty of the process hinders its industrial deployment. Moreover, the utility of nanoporous materials, known to be selective for the CO2/N2 separation, is drastically reduced due to the competitive adsorption with H2O. Taking advantage of the power plant's waste heat to perform CCS while at the same time surmounting the negative effect of H2O is therefore an attractive idea. We propose an upside-down approach for CCS in nanoporous materials, high-temperature adsorption & low-temperature desorption (HALD), that exploits the temperature-dependent competitive adsorption of CO2 and H2O. First, we provide a theoretical background for this entropy-driven behavior and demonstrate under what conditions competitive adsorption can be in favor of CO2 at high temperature and in favor of H2O at low temperature. Then, molecular simulations in all-silica MFI provide a proof of concept. The International Zeolite Association database is subsequently screened for potential candidates and finally, the most promising materials are selected using a post-Pareto search algorithm. The proposed post-Pareto approach is able to select the material that shows an optimal combination of multiple criteria, such as CO2/H2O selectivity, CO2/N2 selectivity,more » CO2 uptake and H2O uptake. As a conclusion, this work provides new perspectives to reduce the energy requirement for CCS and to overcome the competitive adsorption of H2O.« less

Authors:
 [1];  [1];  [2];  [1];  [2]
  1. Ghent Univ., Zwijnaarde (Belgium)
  2. Univ. of California, Berkeley, CA (United States)
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Center for Gas Separations Relevant to Clean Energy Technologies (CGS)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
OSTI Identifier:
1386057
Grant/Contract Number:  
SC0001015
Resource Type:
Accepted Manuscript
Journal Name:
Energy & Environmental Science
Additional Journal Information:
Journal Volume: 8; Journal Issue: 8; Related Information: CGS partners with University of California, Berkeley; University of California, Davis; Lawrence Berkeley National Laboratory; University of Minnesota; National Energy Technology Laboratory; Texas A&M University; Journal ID: ISSN 1754-5692
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; membrane; carbon capture; materials and chemistry by design; synthesis (novel materials); synthesis (self-assembly); synthesis (scalable processing)

Citation Formats

Joos, Lennart, Lejaeghere, Kurt, Huck, Johanna M., Van Speybroeck, Veronique, and Smit, Berend. Carbon capture turned upside down: high-temperature adsorption & low-temperature desorption (HALD). United States: N. p., 2015. Web. doi:10.1039/c5ee01690h.
Joos, Lennart, Lejaeghere, Kurt, Huck, Johanna M., Van Speybroeck, Veronique, & Smit, Berend. Carbon capture turned upside down: high-temperature adsorption & low-temperature desorption (HALD). United States. https://doi.org/10.1039/c5ee01690h
Joos, Lennart, Lejaeghere, Kurt, Huck, Johanna M., Van Speybroeck, Veronique, and Smit, Berend. Tue . "Carbon capture turned upside down: high-temperature adsorption & low-temperature desorption (HALD)". United States. https://doi.org/10.1039/c5ee01690h. https://www.osti.gov/servlets/purl/1386057.
@article{osti_1386057,
title = {Carbon capture turned upside down: high-temperature adsorption & low-temperature desorption (HALD)},
author = {Joos, Lennart and Lejaeghere, Kurt and Huck, Johanna M. and Van Speybroeck, Veronique and Smit, Berend},
abstractNote = {Carbon capture & sequestration (CCS) could reduce CO2 emissions from large fossil-fuel power plants on the short term, but the high energy penalty of the process hinders its industrial deployment. Moreover, the utility of nanoporous materials, known to be selective for the CO2/N2 separation, is drastically reduced due to the competitive adsorption with H2O. Taking advantage of the power plant's waste heat to perform CCS while at the same time surmounting the negative effect of H2O is therefore an attractive idea. We propose an upside-down approach for CCS in nanoporous materials, high-temperature adsorption & low-temperature desorption (HALD), that exploits the temperature-dependent competitive adsorption of CO2 and H2O. First, we provide a theoretical background for this entropy-driven behavior and demonstrate under what conditions competitive adsorption can be in favor of CO2 at high temperature and in favor of H2O at low temperature. Then, molecular simulations in all-silica MFI provide a proof of concept. The International Zeolite Association database is subsequently screened for potential candidates and finally, the most promising materials are selected using a post-Pareto search algorithm. The proposed post-Pareto approach is able to select the material that shows an optimal combination of multiple criteria, such as CO2/H2O selectivity, CO2/N2 selectivity, CO2 uptake and H2O uptake. As a conclusion, this work provides new perspectives to reduce the energy requirement for CCS and to overcome the competitive adsorption of H2O.},
doi = {10.1039/c5ee01690h},
journal = {Energy & Environmental Science},
number = 8,
volume = 8,
place = {United States},
year = {Tue Jun 30 00:00:00 EDT 2015},
month = {Tue Jun 30 00:00:00 EDT 2015}
}

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