Shivangi Singh

Doctoral Student at Chemical Physics

The aim of my project is to understand the hydrothermal dealumination mechanism, role of Al distribution and effect of Cu present in the zeolite for NH3-SCR. This will be done using density functional theory (DFT) calculations. The developed understanding will be used to design experiments that may elucidate the governing mechanisms.

Source: chalmers.se
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Showing 2 publications

2024

Mechanism for Cu-enhanced hydrothermal stability of Cu-CHA for NH3-SCR

Shivangi Singh, Ton Janssens, Henrik Grönbeck
Catalysis Science and Technology. Vol. 14 (12), p. 3407-3415
Journal article

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