Element table of TM-substituted polyoxotungstates for direct electrocatalytic reduction of nitric oxide to ammonia: a DFT guideline for experiments

Author:

Lang Zhongling12345ORCID,Miao Jun678910ORCID,Tan Huaqiao12345ORCID,Su Zhongmin12345ORCID,Li Yangguang12345ORCID,Zheng Zhiping678910ORCID

Affiliation:

1. Key Laboratory of Polyoxometalate Science of the Ministry of Education

2. Faculty of Chemistry

3. Northeast Normal University

4. Changchun

5. China

6. Guangdong Provincial Key Laboratory of Catalysis

7. Shenzhen Grubbs Institute and Department of Chemistry

8. Southern University of Science and Technology

9. Shenzhen

10. P. R. China

Abstract

We screened out NiII, CoII, CuII, PdII, PtII, and AgI substituted heteropolytungstates as promising electrocatalysts for nitric oxide to ammonia with high activity and high selectivity.

Funder

National Natural Science Foundation of China

Fundamental Research Funds for the Central Universities

China Postdoctoral Science Foundation

Education Department of Jilin Province

Jilin Scientific and Technological Development Program

Southern University of Science and Technology

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

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