Covers 2017


Pyridine-decorated carbon nanotubes as a metal-free heterogeneous catalyst for mild CO2 reduction to methanol with hydroboranes.

Giulia Tuci, Andrea Rossin, Lapo Luconi, Cuong Pham-Huu,* Stefano Cicchi, Housseinou Ba, and Giuliano Giambastiani.*

Catal. Sci. & Technol. 2017, 7, 5833-5837.

DOI: 10.1039/C7CY01772C

Publication Date (Web): October 30, 2017. Copyright © 2017 The Royal Society of Chemistry.




Parametrization of a Reactive Force Field (ReaxFF) for Molecular Dynamics Simulations of Si Nanoparticles.

Giovanni Barcaro, Susanna Monti, Luca Sementa, and Vincenzo Carravetta.*

J. Chem. Theory Comput. 2017, 13, (8), 3854-3861.

DOI: 10.1021/acs.jctc.7b00445

Publication Date (Web): June 22, 2017. Copyright © 2017 American Chemical Society.




Unraveling Surface Basicity and Bulk Morphology Relationship on Covalent Triazine Frameworks with Unique Catalytic and Gas Adsorption Properties.

Giulia Tuci, Moritz Pilaski, Housseinou Ba, Andrea Rossin, Lapo Luconi, Stefano Caporali, Cuong Pham‐Huu,* Regina Palkovits,* and Giuliano Giambastiani.*

Adv. Funct. Mater. 2017, 27, (7), 1605672.

DOI: 10.1002/adfm.201605672

Publication Date (Web): January 17, 2017. Copyright © 2017 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim.