Understanding water-induced zeolite dealumination is crucial for control of the hydrothermal stability of zeolite-based catalyst materials for biomass conversion. Using ab initio simulations, we investigate the Al-O(H) bond breaking in an MFI zeolite with the aim to reveal underlying reaction mechanism.
Publications
Fu, D; van der Heijden, O; Stanciakova, K; Schmidt, J E; Weckhuysen, B M Disentangling Reaction Processes of Zeolites within Single-Oriented Channels Journal Article Angewandte Chemie, 132 (36), pp. 15632-15636, 2020. Links | BibTeX @article{Fu202015632,
title = {Disentangling Reaction Processes of Zeolites within Single-Oriented Channels},
author = {D Fu and O van der Heijden and K Stanciakova and J E Schmidt and B M Weckhuysen},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85089772662&doi=10.1002%2fange.201916596&partnerID=40&md5=dd9b698448b82f5e4570a7bfe103ee19},
year = {2020},
date = {2020-01-01},
journal = {Angewandte Chemie},
volume = {132},
number = {36},
pages = {15632-15636},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
|
Fu, D; van der Heijden, O; Stanciakova, K; Schmidt, J E; Weckhuysen, B M Disentangling Reaction Processes of Zeolites within Single-Oriented Channels Journal Article Angewandte Chemie - International Edition, 59 (36), pp. 15502-15506, 2020. Links | BibTeX @article{Fu202015502,
title = {Disentangling Reaction Processes of Zeolites within Single-Oriented Channels},
author = {D Fu and O van der Heijden and K Stanciakova and J E Schmidt and B M Weckhuysen},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85080980510&doi=10.1002%2fanie.201916596&partnerID=40&md5=89edcd91946746e902a09b029d47d8d0},
year = {2020},
date = {2020-01-01},
journal = {Angewandte Chemie - International Edition},
volume = {59},
number = {36},
pages = {15502-15506},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
|
Louwen, J N; Simko, S; Stanciakova, K; Bulo, R E; Weckhuysen, B M; Vogt, E T C Role of Rare Earth Ions in the Prevention of Dealumination of Zeolite y for Fluid Cracking Catalysts Journal Article Journal of Physical Chemistry C, 124 (8), pp. 4626-4636, 2020. Links | BibTeX @article{Louwen20204626,
title = {Role of Rare Earth Ions in the Prevention of Dealumination of Zeolite y for Fluid Cracking Catalysts},
author = {J N Louwen and S Simko and K Stanciakova and R E Bulo and B M Weckhuysen and E T C Vogt},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85080030959&doi=10.1021%2facs.jpcc.9b11956&partnerID=40&md5=c2ab3f8d6a457e81101217b412433ecb},
year = {2020},
date = {2020-01-01},
journal = {Journal of Physical Chemistry C},
volume = {124},
number = {8},
pages = {4626-4636},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
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Stanciakova, K; Ensing, B; Göltl, F; Bulo, R E; Weckhuysen, B M Cooperative Role of Water Molecules during the Initial Stage of Water-Induced Zeolite Dealumination Journal Article ACS Catalysis, 9 (6), pp. 5119-5135, 2019. Links | BibTeX @article{Stanciakova20195119,
title = {Cooperative Role of Water Molecules during the Initial Stage of Water-Induced Zeolite Dealumination},
author = {K Stanciakova and B Ensing and F Göltl and R E Bulo and B M Weckhuysen},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85067110944&doi=10.1021%2facscatal.9b00307&partnerID=40&md5=3f7e2aa7ccb20dc7fdb32e377edeb3e5},
year = {2019},
date = {2019-01-01},
journal = {ACS Catalysis},
volume = {9},
number = {6},
pages = {5119-5135},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
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