Abstract
DFT calculations on TS-1 model clusters showed that activation of hydrogen peroxide on titanium silicalite-1 (TS-1) led to form a water adduct of peroxy TS-1 complex, which was examined as an oxidizing agent in the catalytic reaction cycle to produce epoxyethane from ethene.
Original language | English |
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Pages (from-to) | 227-232 |
Number of pages | 6 |
Journal | Studies in Surface Science and Catalysis |
Volume | 121 |
DOIs | |
Publication status | Published - 1999 |
ASJC Scopus subject areas
- Catalysis
- Condensed Matter Physics
- Physical and Theoretical Chemistry
- Surfaces, Coatings and Films
- Materials Chemistry