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Royal Society of Chemistry, Journal of Materials Chemistry C Materials for optical and electronic devices, 38(11), p. 13085-13094, 2023

DOI: 10.1039/d3tc01381b

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Insights into the capture mechanism of CO<sub>2</sub> by diamine-appended Mg<sub>2</sub>(dobpdc): a combined DFT and microkinetic modeling study

Journal article published in 2023 by Kuan-Yu Lin ORCID, Zhong-Ming Xie, Lu-Sheng Hong, Jyh-Chiang Jiang ORCID
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

The mechanism of CO2 adsorption in mmen-Mg2 (dobpdc) MOF was systematically investigated and revealed novel insight into the development of diamine-functionalized MOF for CO2 capture.