Title: Projector-Based Embedding Eliminates Density Functional Dependence for QM/MM Calculations of Reactions in Enzymes and Solution Year: 2019
Authors (8):
S. J. Bennie, N. Lawan, S. J. Macrae, F. R. Manby, A. J. Mulholland, K. E. Ranaghan, D. Shchepanovska, J. Zurek
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.8b00940 article-journal
Themes: Biocatalysis (2019)
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Title: Synchrotron Radiation and Catalytic Science Year: 2020
Authors (11):
C. Hardacre, A. M. Beale, E. K. Gibson, J. B. M. .Goodall, A. Goguet, S. A. Kondrat, G. Malta, C. E. Stere, P. P. Wells, G. J. Hutchings, C. R. A. .Catlow
Publisher: Synchrotron Radiation News
DOI: 10.1080/08940886.2020.1701368 article-journal
Themes: Core (2020), Collaborations (2020), Featured (2020)
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Title: Synthetic strategies to nanostructured photocatalysts for CO2reduction to solar fuels and chemicals Year: 2015
Authors (3):
D. Chen, X. Zhang, A. F. Lee
Publisher: Journal of Materials Chemistry A
DOI: 10.1039/c5ta01592h article-journal
Themes: Energy (2015)
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Title: The influence of oxygen vacancy and Ce3+ ion positions on the properties of small gold clusters supported on CeO2−x(111) Year: 2020
Authors (4):
J. Engel, E. Schwartz, C. R. A. .Catlow, A. Roldan
Publisher: Journal of Materials Chemistry A
DOI: 10.1039/d0ta01398f journal-article
Themes: New Catalysts (2020)
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Title: The nature and effects of rhodium and antimony dopants on the electronic structure of TiO2: towards design of Z-scheme photocatalysts Year: 2016
Authors (4):
E. N. . K. .Glover, S. G. .Ellington, G. Sankar, R. G. Palgrave
Publisher: Journal of Materials Chemistry A
DOI: 10.1039/c6ta00293e article-journal
Themes: BAG (2016)
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Title: Using the Colloidal Method to Prepare Au Catalysts for the Alkylation of Aniline by Benzyl Alcohol Year: 2023
Authors (6):
L. V. Hare, F. Parveen, J. Cookson, P. R. Ellis, K. Hellgardt, K. K. (M. )Hii
Publisher: International Journal of Molecular Sciences
DOI: 10.3390/ijms241914779 journal-article
Themes: Circular Economy (2023)
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