Browsing by Author "Sun Hee, Yoon"
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Effect of Fe/N-doped carbon nanotube (CNT) wall thickness on CO2 conversion: A DFT study
Sun Hee, Yoon; Park, Hyunwoong; Elbashir, Nimir O.; Han, Dong Suk ( Elsevier , 2020 , Article)Many researches on CO2 adsorption using carbon nanotubes (CNTs) have been actively studied, but experimental and theoretical studies on CO2 conversion are still in demand. In particular, the effect of CNT wall thickness ... -
Theoretical insight into effect of cation–anion pairs on CO2 reduction on bismuth electrocatalysts
Sun Hee, Yoon; Piao, Guangxia; Park, Hyunwoong; Elbashir, Nimir O.; Han, Dong Suk ( Elsevier , 2020 , Article)This study presents theoretical insight into the mechanism of the CO2 reduction reaction (CO2RR) to formic acid (HCOOH) on Bi (012) surfaces in the presence of alkali metal cations (M+: Cs+, K+, and Li+) and/or halide ...