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Dr. Yan Jiao, Yao Zheng, Prof. Sean C. Smith, Prof. Aijun Du and Prof. Zhonghua Zhu Electrocatalytically Switchable CO2 Capture: First Principle Computational Exploration of Carbon Nanotubes with Pyridinic Nitrogen ChemSusChem 7

Version of Record online: 2 FEB 2014 | DOI: 10.1002/cssc.201300624

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That′s dope! Carbon nanotubes with pyridinic nitrogen doping are proposed for controllable, highly selective, and reversible CO2 capture. Density functional theory studies show that pyridinic nitrogen incorporation induces an increased CO2 adsorption strength with electron injecting, leading to a highly selective CO2 adsorption. Reversible CO2 adsorption can be achieved by switching the charge carrying state of the system on/off.

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