Computationally directed manipulation of cross-linked covalent organic frameworks for membrane applications

Davies, Alathea E.; Wenzel, Michael J.; Brugger, Cailin L.; Johnson, Jordan; Parkinson, Bruce A.; Hoberg, John O.; de Sousa Oliveira, Laura

doi:10.1039/D3CP04452A

Title: Computationally directed manipulation of cross-linked covalent organic frameworks for membrane applications

Journal Article · 22 November 2023 · Physical Chemistry Chemical Physics. PCCP

DOI: https://doi.org/10.1039/D3CP04452A · OSTI ID:2205411

^[1]; Wenzel, Michael J. ^[1]; Brugger, Cailin L. ^[1]; Johnson, Jordan ^[1]; Parkinson, Bruce A. ^[2];

^[1];

^[1]

Department of Chemistry, University of Wyoming, Laramie, WY 82071, USA
School of Energy Resources, University of Wyoming, Laramie, WY 82071, USA

A quinoxaline-based covalent organic framework (COF) was synthetically cross-linked and investigated for membrane applications. Ab initio calculations were conducted to investigate the stability of cross-linked COFs.

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Sponsoring Organization:: USDOE

Grant/Contract Number:: SC0020100

OSTI ID:: 2205411

Journal Information:: Physical Chemistry Chemical Physics. PCCP, Journal Name: Physical Chemistry Chemical Physics. PCCP Vol. 25 Journal Issue: 45; ISSN 1463-9076

Publisher:: Royal Society of Chemistry (RSC)Copyright Statement

Country of Publication:: United Kingdom

Language:: English

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