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Influence of H-bonds on the photoionization of aromatic chromophores in water: The aniline molecule
J. Chem. Phys. 2023, 158 (19), 191102, DOI: 10.1063/5.0147503. -
Microkinetic modelling in computational homogeneous catalysis and beyond
Theor. Chem. Acc. 2023, 142 (10), 99, DOI: 10.1007/s00214-023-03044-2. -
Impact of Bidentate Pyridyl-Mesoionic Carbene Ligands: Structural, (Spectro)Electrochemical, Photophysical, and Theoretical Investigations on Ruthenium(II) Complexes
GO TO OPEN ACCESS ACS Org. Inorg. Au 2023, 3 (4), 184-198, DOI: 10.1021/acsorginorgau.3c00005. -
Regiodivergent sp3 C–H Functionalization via Ni-Catalyzed Chain-Walking Reactions
GO TO OPEN ACCESS JACS Au 2023, 3 (12), 3270–3282, DOI: 10.1021/jacsau.3c00617. -
Imidazole-derived carbenes and salts boost nickel-catalyzed ester carbonylation activity
Chem Cat 2023, 3 (12), 100863, DOI: 10.1016/j.checat.2023.100863. -
A computational search of the ideal metal fragment for monohapto coordination of dihydrogen
Aust. J. Chem. 2023, 76, 885-892, DOI: 10.1071/CH23121. -
Monodentate versus Bidentate Anchoring Groups in Self-Assembling Molecules (SAMs) for Robust p–i–n Perovskite Solar Cells
ACS Appl. Mater. Interfaces 2023, 15 (49), 57153–57164, DOI: 10.1021/acsami.3c13727. -
Computational Studies towards the Optimization of the Synthesis of 1,2,4-Triazolo[1,5-a]pyridine-2-carboxylate: Advantages of Continuous Flow Processing
Eur. J. Org. Chem. 2023, DOI: 10.1002/ejoc.202300921. -
Lattice-Stabilized Chromium Atoms on Ceria for N2O Synthesis
GO TO OPEN ACCESS ACS Catal. 2023, 13 (24), 15977-15990, DOI: 10.1021/acscatal.3c04463. -
Self-assembled molecules as selective contacts for efficient and stable perovskite solar cells
GO TO OPEN ACCESS Mat. Chem. Front. 2023, DOI: 10.1039/d3qm01017a.