Highly Efficient Electrocatalytic N₂ Reduction to Ammonia over Metallic 1T Phase of MoS₂ Enabled by Active Sites Separation Mechanism Article Swipe

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Ruoqi Liu , Ting Guo , Hao Fei , Zhuangzhi Wu , Dezhi Wang , Fangyang Liu ·

YOU? · · 2021 · Open Access · · DOI: https://doi.org/10.1002/advs.202103583

The 1T phase of MoS 2 has been widely reported to be highly active toward the hydrogen evolution reaction (HER), which is expected to restrict the competitive nitrogen reduction reaction (NRR). However, in this work, a prototype of active sites separation over 1T‐MoS 2 is proposed by DFT calculations that the Mo‐edge and S atoms on the basal plane exhibit different catalytic NRR and HER selectivity, and a new role‐playing synergistic mechanism is also well enabled for the multistep NRR, which is further experimentally confirmed. More importantly, a self‐sacrificial strategy using g‐C 3 N 4 as templates is proposed to synthesize 1T‐MoS 2 with an ultrahigh 1T content (75.44%, named as CNMS, representing the composition elements of C, N, Mo, and S), which yields excellent NRR performances with an ammonia formation rate of 71.07 µg h –1 mg –1 cat. at −0.5 V versus RHE and a Faradic efficiency of 21.01%. This work provides a promising new orientation of synchronizing the selectivity and activity for the multistep catalytic reactions.

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Selectivity Catalysis Ammonia Ammonia production Phase (matter) Metal Redox Electrocatalyst Chemistry Synchronizing Materials science Hydrogen Inorganic chemistry Chemical engineering Physical chemistry Electrochemistry Electrode Topology (electrical circuits) Organic chemistry Combinatorics Mathematics Engineering

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Type: article
Language: en
Landing Page: https://doi.org/10.1002/advs.202103583
OA Status: gold
Cited By: 48
References: 51
Related Works: 10
OpenAlex ID: https://openalex.org/W3210223514

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DOI: https://doi.org/10.1002/advs.202103583

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Title: Highly Efficient Electrocatalytic N₂ Reduction to Ammonia over Metallic 1T Phase of MoS₂ Enabled by Active Sites Separation Mechanism

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Language: en

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Publication year: 2021

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Publication date: 2021-11-05

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Authors: Ruoqi Liu, Ting Guo, Hao Fei, Zhuangzhi Wu, Dezhi Wang, Fangyang Liu

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Landing page: https://doi.org/10.1002/advs.202103583

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Concepts: Selectivity, Catalysis, Ammonia, Ammonia production, Phase (matter), Metal, Redox, Electrocatalyst, Chemistry, Synchronizing, Materials science, Hydrogen, Inorganic chemistry, Chemical engineering, Physical chemistry, Electrochemistry, Electrode, Topology (electrical circuits), Organic chemistry, Combinatorics, Mathematics, Engineering

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Cited by: 48

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Highly Efficient Electrocatalytic N2 Reduction to Ammonia over Metallic 1T Phase of MoS2 Enabled by Active Sites Separation Mechanism Article Swipe

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Highly Efficient Electrocatalytic N₂ Reduction to Ammonia over Metallic 1T Phase of MoS₂ Enabled by Active Sites Separation Mechanism Article Swipe