Title: Comparing ammonia diffusion in NH3-SCR zeolite catalysts: a quasielastic neutron scattering and molecular dynamics simulation study Year: 2018
Authors (7):
A. J. O'Malley, M. Sarwar, J. Armstrong, C. R. A. .Catlow, I. P. Silverwood, A. P. E. .York, I. Hitchcock
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c8cp01022f article-journal
Themes: Design (2018)
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Title: Computational QM/MM investigation of the adsorption of MTH active species in H-Y and H-ZSM-5 Year: 2019
Authors (4):
S. A. F. .Nastase, A. J. O'Malley, C. R. A. .Catlow, A. J. Logsdail
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c8cp06736h article-journal
Themes: Design (2018)
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Title: Adams Method Prepared Metal Oxide Catalysts for Solar-Driven Water Splitting Year: 2018
Authors (4):
M. P. Browne, C. O'Rourke, N. Wells, A. Mills
Publisher: ChemPhotoChem
DOI: 10.1002/cptc.201700210 article-journal
Themes: Energy (2018)
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Title: Pd local structure and size correlations to the activity of Pd/TiO2 for photocatalytic reforming of methanol Year: 2019
Authors (6):
N. Abdullah, H. Bahruji, S. M. Rogers, P. P. Wells, C. R. A. .Catlow, M. Bowker
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c9cp00826h article-journal
Themes: Design (2019), Environment (2019), BAG (2019)
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Title: Catalytic applications of small bite-angle diphosphorus ligands with single-atom linkers Year: 2017
Authors (1):
S. M. Mansell
Publisher: Dalton Transactions
DOI: 10.1039/c7dt03395h article-journal
Themes: Collaborations (2017)
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Title: Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants Year: 2017
Authors (4):
W. Beker, M. W. van der Kamp, A. J. Mulholland, W. A. Sokalski
Publisher: Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.6b01131 article-journal
Themes: Biocatalysis (2017)
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Title: A ruthenium(ii) bis(phosphinophosphinine) complex as a precatalyst for transfer-hydrogenation and hydrogen-borrowing reactions Year: 2017
Authors (4):
R. J. Newland, M. F. .Wyatt, R. L. Wingad, S. M. Mansell
Publisher: Dalton Transactions
DOI: 10.1039/c7dt01022b article-journal
Themes: Biocatalysis (2017), Environment (2017)
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Title: The adsorption of Cu on the CeO2(110) surface Year: 2017
Authors (8):
A. Chutia, E. K. Gibson, M. R. Farrow, P. P. Wells, D. O. Scanlon, N. Dimitratos, D. J. Willock, C. R. A. .Catlow
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c7cp04144f article-journal
Themes: Design (2017), BAG (2017)
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Title: The adsorbed state of a thiol on palladium nanoparticles Year: 2016
Authors (8):
S. M. Rogers, N. Dimitratos, W. Jones, M. Bowker, A. G. Kanaras, P. P. Wells, C. R. A. .Catlow, S. F. Parker
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c6cp00957c article-journal
Themes: Design (2016)
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Title: Methanol diffusion in zeolite HY: a combined quasielastic neutron scattering and molecular dynamics simulation study Year: 2016
Authors (6):
A. J. O'Malley, V. García-Sakai, I. P. Silverwood, N. Dimitratos, S. F. Parker, C. R. A. .Catlow
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c6cp01151a article-journal
Themes: Design (2016)
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