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The electronic structures of non-metal (N, S) doped cobalt phosphide catalysts and the catalytic mechanism for the hydrogen evolution reaction of ammonia borane: a theoretical study
- Source :
- New Journal of Chemistry. 47:1724-1730
- Publication Year :
- 2023
- Publisher :
- Royal Society of Chemistry (RSC), 2023.
-
Abstract
- The electronic structures of non-metal (N, S) doped CoP catalysts and the mechanism of the hydrogen evolution reaction of ammonia borane catalyzed by three catalysts were studied using density functional theory.
- Subjects :
- Materials Chemistry
General Chemistry
Catalysis
Subjects
Details
- ISSN :
- 13699261 and 11440546
- Volume :
- 47
- Database :
- OpenAIRE
- Journal :
- New Journal of Chemistry
- Accession number :
- edsair.doi...........aba539a64a38e5f9caf7c3e13ff9a1a1