A1 Journal article (refereed)
First Principles Calculations for Hydrogenation of Acrolein on Pd and Pt: Chemoselectivity Depends on Steric Effects on the Surface (2016)


Tuokko, S., Pihko, P., & Honkala, K. (2016). First Principles Calculations for Hydrogenation of Acrolein on Pd and Pt: Chemoselectivity Depends on Steric Effects on the Surface. Angewandte Chemie International Edition, 55 (5), 1670-1674. doi:10.1002/anie.201507631


JYU authors or editors


Publication details

All authors or editors: Tuokko, Sakari; Pihko, Petri; Honkala, Karoliina

Journal or series: Angewandte Chemie International Edition

ISSN: 1433-7851

Publication year: 2016

Volume: 55

Issue number: 5

Pages range: 1670-1674

Publisher: Wiley - VCH Verlag GmbH & Co. KGaA

Publication country: Germany

Publication language: English

DOI: https://doi.org/10.1002/anie.201507631

Open Access: Publication channel is not openly available


Keywords: density functional theory; surface chemistry

Free keywords: chemoselectivity; heterogeneous catalysis; reaction mechanism


Contributing organizations


Ministry reporting: Yes

Reporting Year: 2016

JUFO rating: 3


Last updated on 2020-17-10 at 19:05