2021
DOI: 10.1039/d1ee00569c
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Fe1N4–O1 site with axial Fe–O coordination for highly selective CO2 reduction over a wide potential range

Abstract: The proposed working mechanism of the electrochemical CO2 reduction reaction on Fe1N4, Fe1N4–N1, and Fe1N4–O1 active sites.

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Cited by 138 publications
(135 citation statements)
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“…In addition, this phenomenon has also been observed on FeN 4 -O 1 and CoN 5 SACs. [43,53] Moreover,t he difference between thermodynamic limiting potentials for CO 2 RR and HER (U L (CO 2 )-U L (H 2 )) has been calculated to understand the selectivity of the models. [54] As shown in Figure 1D,the U L (CO 2 )-U L (H 2 )values of FeN 4 , CoN 4 ,NiN 4 ,and CdN 4 are negative,indicating that the HER occurred preferentially,a nd the *H may suppress the adsorption of *COOH and *CO,l eading to the poor selectivity for CO 2 RR.…”
Section: Methodsmentioning
confidence: 99%
“…In addition, this phenomenon has also been observed on FeN 4 -O 1 and CoN 5 SACs. [43,53] Moreover,t he difference between thermodynamic limiting potentials for CO 2 RR and HER (U L (CO 2 )-U L (H 2 )) has been calculated to understand the selectivity of the models. [54] As shown in Figure 1D,the U L (CO 2 )-U L (H 2 )values of FeN 4 , CoN 4 ,NiN 4 ,and CdN 4 are negative,indicating that the HER occurred preferentially,a nd the *H may suppress the adsorption of *COOH and *CO,l eading to the poor selectivity for CO 2 RR.…”
Section: Methodsmentioning
confidence: 99%
“…Meanwhile, the same conclusion can be drawn from the rst derivative curve (Fig. 2b), 33,42 24,25 The wavelet transforms (WT) was resorted to demonstrate the existence of single-atom dispersed Ni species in the samples. 42,43 As shown in Fig.…”
Section: Resultsmentioning
confidence: 54%
“…2e and S12 †) to optimize the active site structure. 22,24 Under the alkaline condition, we examined the Volmer-Heyrovsky mechanism (Fig. 4a), which involves three steps: (i) the water molecule is physically adsorbed at rst on the Ni metal center and is then dissociated into H* adatom and OH À ; (ii) another H 2 O molecule is adsorbed on the H-Ni bond and it directly reacts with the H* adatom that forms H 2 *, accompanied by the OH À desorption.…”
Section: Density Functional Theory (Dft) Calculationsmentioning
confidence: 99%
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“…It can be seen SACs. [43,53] Moreover,t he difference between thermodynamic limiting potentials for CO 2 RR and HER (U L (CO 2 )-U L (H 2 )) has been calculated to understand the selectivity of the models. [54] As shown in Figure 1D,the U L (CO 2 )-U L (H 2 )values of FeN 4 , CoN 4 ,NiN 4 ,and CdN 4 are negative,indicating that the HER occurred preferentially,a nd the *H may suppress the adsorption of *COOH and *CO,l eading to the poor selectivity for CO 2 RR.…”
Section: Resultsmentioning
confidence: 99%