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: 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: 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: Contrasting the EXAFS obtained under air and H2 environments to reveal details of the surface structure of Pt–Sn nanoparticles Year: 2021
Authors (7):
H. Huang, A. B. A. A. Nassr, V. Celorrio, D. Gianolio, C. Hardacre, D. J. L. .Brett, A. E. Russell
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/d1cp00979f article-journal
Themes: Energy (2021)
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Title: Switchable Polymerization Catalysis Using a Tin(II) Catalyst and Commercial Monomers to Toughen Poly(l-lactide) Year: 2021
Authors (4):
N. Yuntawattana, G. L. Gregory, L. P. ñA. Carrodeguas, C. K. Williams
Publisher: ACS Macro Letters
DOI: 10.1021/acsmacrolett.1c00216 journal-article
Themes: Circular Economy (2021)
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Title: Mechanisms of ammonia and hydrazine synthesis on η-Mn3N2-(100) surfaces Year: 2019
Authors (1):
C. D. Zeinalipour-Yazdi
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c9cp03934a journal-article
Themes: Design (2019)
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Title: QM/MM study of the stability of dimethyl ether in zeolites H-ZSM-5 and H-Y Year: 2021
Authors (3):
S. A. F. .Nastase, C. R. A. .Catlow, A. J. Logsdail
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/d0cp05392a journal-article
Themes: Collaborations (2021)
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