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Vol 2, 2023 - 161957
Pôster / Poster
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Abstract

*The UK Catalysis Hub is a long running UKRI (EPSRC) programme that brings together Catalytic research from over 25 UK University.
*This talk will examine how modern multiscale modelling techniques can bridge the gaps between biological- homogenous- and heterogenous- catalysis communities.
*Specific focus will be given to how joint computational/experimental approaches can help in the design of more sustainable catalysis.

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Institutions
  • 1 Cardiff University / Cardiff University / School of Chemistry
Track
  • Homogeneous/Heterogeneous Catalysis
Keywords
Sustainable Catalysis; circular economy; Computational chemistry; Quantum Mechanics/Molecular Mechanics