Porous Covalent Organic Polymers for Efficient Fluorocarbon‐Based Adsorption Cooling

Zheng, Jian; Wahiduzzaman, Mohammad; Barpaga, Dushyant; Trump, Benjamin A.; Gutiérrez, Oliver Y.; Thallapally, Praveen; Ma, Shengqian; McGrail, B. Peter; Maurin, Guillaume; Motkuri, Radha Kishan

doi:10.1002/ange.202102337

Title: Porous Covalent Organic Polymers for Efficient Fluorocarbon‐Based Adsorption Cooling

Journal Article · 03 June 2021 · Angewandte Chemie

DOI: https://doi.org/10.1002/ange.202102337 · OSTI ID:1786255

^[1];

^[2];

^[3]; Trump, Benjamin A. ^[4];

^[5]; Thallapally, Praveen ^[5]; Ma, Shengqian ^[6]; McGrail, B. Peter ^[3];

^[2]; Motkuri, Radha Kishan ^[3]

Department of Chemical Engineering Sichuan University Chengdu 610065 P. R. China, Physical and Computational Sciences Directorate Pacific Northwest National Laboratory Richland WA 99352 USA
ICGM Univ. Montpellier CNRS ENSCM Montpellier France
Energy and Environment Directorate Pacific Northwest National Laboratory Richland WA 99352 USA
Center for Neutron Diffraction National Institute of Standards and Technology Gaithersburg MD 20899 USA
Physical and Computational Sciences Directorate Pacific Northwest National Laboratory Richland WA 99352 USA
Department of Chemistry University of North Texas Denton TX 76201 USA

Abstract Adsorption‐based cooling is an energy‐efficient renewable‐energy technology that can be driven using low‐grade industrial waste heat and/or solar heat. Here, we report the first exploration of fluorocarbon adsorption using porous covalent organic polymers (COPs) for this cooling application. High fluorocarbon R134a equilibrium capacities and unique overall linear‐shaped isotherms are revealed for the materials, namely COP‐2 and COP‐3. The key role of mesoporous defects on this unusual adsorption behavior was demonstrated by molecular simulations based on atomistic defect‐containing models built for both porous COPs. Analysis of simulated R134a adsorption isotherms for various defect‐containing atomistic models of the COPs shows a direct correlation between higher fluorocarbon adsorption capacities and increasing pore volumes induced by defects. Combined with their high porosities, excellent reversibility, fast kinetics, and large operating window, these defect‐containing porous COPs are promising for adsorption‐based cooling applications.

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Sponsoring Organization:: USDOE

Grant/Contract Number:: AC05-76RL01830

OSTI ID:: 1786255

Journal Information:: Angewandte Chemie, Journal Name: Angewandte Chemie Journal Issue: 33 Vol. 133; ISSN 0044-8249

Publisher:: Wiley Blackwell (John Wiley & Sons)Copyright Statement

Country of Publication:: Germany

Language:: English

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