Title: A DFT and KMC based study on the mechanism of the water gas shift reaction on the Pd(100) surface Year: 2020
Authors (4):
A. Chutia, A. Thetford, M. Stamatakis, C. R. A. .Catlow
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c9cp05476f article-journal
Themes: Design (2020)
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Title: A Noncanonical Proximal Heme Ligand Affords an Efficient Peroxidase in a Globin Fold Year: 2018
Authors (6):
M. Pott, T. Hayashi, T. Mori, P. R. E. .Mittl, A. P. Green, D. Hilvert
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.7b12621 article-journal
Themes: Biocatalysis (2018)
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Title: A Noncanonical Tryptophan Analogue Reveals an Active Site Hydrogen Bond Controlling Ferryl Reactivity in a Heme Peroxidase Year: 2021
Authors (11):
M. Ortmayer, F. J. Hardy, M. G. Quesne, K. Fisher, C. Levy, D. J. Heyes, C. R. A. .Catlow, S. P. de Visser, S. E. J. .Rigby, S. Hay, A. P. Green
Publisher: JACS Au
DOI: 10.1021/jacsau.1c00145 article-journal
Themes: New Catalysts (2021)
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Title: A Workflow Demonstrator for Processing Catalysis Research Data Year: 2022
Authors (8):
A. Nieva de la Hidalga, D. Decarolis, S. Xu, S. K. Matam, W. Y. H. Enciso, J. B. M. .Goodall, B. Matthews, C. R. A. .Catlow
Publisher: Data Intelligence
DOI: 10.1162/dint_a_00143 journal-article
Themes: Core (2022), New Catalysts (2022)
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Title: Activation and Deactivation of a Robust Immobilized Cp*Ir-Transfer Hydrogenation Catalyst: A Multielement in Situ X-ray Absorption Spectroscopy Study Year: 2015
Authors (13):
G. J. Sherborne, M. R. Chapman, A. J. Blacker, R. A. Bourne, T. W. Chamberlain, B. D. Crossley, S. J. Lucas, P. C. McGowan, M. A. Newton, T. E. O. Screen, P. B. J. .Thompson, C. E. Willans, B. N. Nguyen
Publisher: Journal of the American Chemical Society
DOI: 10.1021/ja512868a article-journal
Themes: BAG (2015)
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Title: Al-doped Fe2O3 as a support for molybdenum oxide methanol oxidation catalysts Year: 2020
Authors (8):
M. Bowker, P. Hellier, D. Decarolis, D. Gianolio, K. M. H. .Mohammed, A. Stenner, T. Huthwelker, P. P. Wells
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/d0cp01192d article-journal
Themes: Design (2020)
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Title: Ammonia mobility in chabazite: insight into the diffusion component of the NH3-SCR process Year: 2016
Authors (8):
A. J. O'Malley, I. Hitchcock, M. Sarwar, I. P. Silverwood, S. Hindocha, C. R. A. .Catlow, A. P. E. .York, P. Collier
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c6cp01160h article-journal
Themes: Design (2016)
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Title: An experimental and computational IR and hybrid DFT-D3 study of the conformations of l-lactic and acrylic acid: new insight into the dehydration mechanism of lactic acid to acrylic acid Year: 2019
Authors (2):
C. D. Zeinalipour-Yazdi, C. R. A. .Catlow
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c9cp02968k article-journal
Themes: Design (2019)
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Title: An investigation of the effect of carbon support on ruthenium/carbon catalysts for lactic acid and butanone hydrogenation Year: 2016
Authors (8):
D. R. Jones, S. Iqbal, S. A. Kondrat, G. M. Lari, P. J. Miedziak, D. J. Morgan, S. F. Parker, G. J. Hutchings
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c6cp01311b article-journal
Themes: Environment (2015)
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Title: Artificial Metalloenzymes as Catalysts for Oxidative Lignin Degradation Year: 2018
Authors (7):
M. V. Doble, A. G. Jarvis, A. C. C. .Ward, J. D. Colburn, J. P. Götze, M. Bühl, P. C. J. .Kamer
Publisher: ACS Sustainable Chemistry & Engineering
DOI: 10.1021/acssuschemeng.8b03568 article-journal
Themes: Biocatalysis (2018)
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