Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Lisa Warczinski"'
Autor:
Christof Hättig, Lisa Warczinski
Publikováno v:
The Journal of Physical Chemistry C. 125:9020-9031
The process of hydrogen spillover on metal nanoparticle decorated carbon surfaces has been discussed for many years due to its importance for heterogeneous catalysis and hydrogen storage. The prese...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::bd2c7bb00c0855ac15924808521eb3aa
https://doi.org/10.1021/acs.jpcc.0c11412
https://doi.org/10.1021/acs.jpcc.0c11412
Autor:
Mariia Merko, Bin Hu, Wolfgang Kleist, Christof Hättig, Johannes Bitzer, Till Eckhard, Jonas Schulwitz, Mingshi Li, Baoxiang Peng, Xiaoyu Li, Lisa Warczinski, Qi Fu, Mohong Lu, Martin Muhler, Markus Heidelmann
Publikováno v:
Angewandte Chemie. 133:6882-6891
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e93a71394ebc76200fac5dab5e1a8eee
https://doi.org/10.1002/ange.202012816
https://doi.org/10.1002/ange.202012816
Publikováno v:
Journal of Computational Chemistry. 40:2491-2501
Advanced wave function-based quantum chemical ab initio methods, such as CCSD(T), are able to calculate the energies of small- to medium-sized molecules with chemical accuracy. Unfortunately, these methods scale quite unfavorably with the size of the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e3aa303f855256ce8709a816da826db5
https://doi.org/10.1002/jcc.26025
https://doi.org/10.1002/jcc.26025
Autor:
Lisa Warczinski, Christof Hättig
Publikováno v:
Physical Chemistry Chemical Physics. 21:21577-21587
A key step for achieving better insight into catalytic hydrogenation reactions is to understand in detail the process of hydrogen adsorption on the catalyst. The present article focuses on hydrogen adsorption on carbon-supported palladium clusters, w
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::239d7978f0eea7c8c19b6dc2b572b78c
https://doi.org/10.1039/c9cp04606b
https://doi.org/10.1039/c9cp04606b
Autor:
Lisa Warczinski, Mingshi Li, Mariia Merko, Markus Heidelmann, Till Eckhard, Baoxiang Peng, Martin Muhler, Mohong Lu, Johannes Bitzer, Xiaoyu Li, Jonas Schulwitz, Wolfgang Kleist, Bin Hu, Christof Hättig, Qi Fu
Publikováno v:
Angewandte Chemie / International edition 60(12), 6807-6815 (2021). doi:10.1002/anie.202012816
Angewandte Chemie (International Ed. in English)
Angewandte Chemie (International Ed. in English)
Angewandte Chemie / International edition 60(12), 6807 - 6815 (2021). doi:10.1002/anie.202012816
Biomass‐derived 5‐hydroxymethylfurfural (HMF) is regarded as one of the most promising platform chemicals to produce 2,5‐dimethylfuran (DMF) a
Biomass‐derived 5‐hydroxymethylfurfural (HMF) is regarded as one of the most promising platform chemicals to produce 2,5‐dimethylfuran (DMF) a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::601c0adcb7f5065558edf85ea126031d
https://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&origin=inward&scp=85099979879
https://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&origin=inward&scp=85099979879
Publikováno v:
Physical chemistry chemical physics : PCCP. 22(37)
Pd nanoparticles deposited on nitrogen-doped mesoporous carbon are promising catalysts for highly selective and effective catalytic hydrogenation reactions. To design and utilize these novel catalysts, it is essential to understand the effect of N do
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::80b8db82e4bdaa471de6def7d59659c2
https://pubmed.ncbi.nlm.nih.gov/32935678
https://pubmed.ncbi.nlm.nih.gov/32935678