Zeolite Hydrolysis
- Ab Initio molecular dynamics/biased dynamics simulations
- Zeolite hydrolysis mechanisms under realistic conditions
- Dynamical simulation of NMR spectra
Selected publications on the topic
C. J. Heard
L. Grajciar
P. Nachtigall
The effect of water on the validity of Löwenstein\textquotesingles rule
The effect of water on the validity of Löwenstein\textquotesingles rule
Chemical Science,
10(22),
2019