2026
76
Pressure-Dependent Kinetics of the NH3 + OH Reaction from Cryogenic to High Temperatures
D. Moura, J. L. Nascimento, V. H. Menezes da Silva, T. V. Alves
Computational and Theoretical Chemistry, 1261, 115824 (2026).
75
Photophysical pathways of 2,4-dithiothymine in microhydrated clusters: insights from theory into UVA activity
M. H. Queiroz, T. V. Alves, R. Rivelino
Computational and Theoretical Chemistry, 1260, 115816 (2026).
74
On the Aromaticity in Cyclic H-Bonded Chains: Linking HOMIA Descriptor to Molecular Properties
M. H. Queiroz, S. A. Santos, T. V. Alves, R. Rivelino
ChemistrySelect, 11, e04083 (2026).
73
Portable SERS Detection of Dipicolinic Acid with AgAu Nanostructures
F. G. da Silva, S. Wang, P. Talebi, E. Lemetti, T. V. Alves, M. Kuula, H. Hakulinen, M. Vainio, P. H. C. Camargo
ACS Applied Nano Materials, 9, 675 (2026).
72
Exploring the elusive catalytic role of water in the OH + furan reaction
J. L. Nascimento, D. Moura, E. Santana, V. H. Menezes da Silva, T. V. Alves
Computational and Theoretical Chemistry, 1256, 115616 (2026).
71
Electrochemical water oxidation mechanisms involving macrocyclic copper(II) complexes: Ligand ring size effects on catalytic cycles
J. P. C. S. Neves, R. Rivelino, T. V. Alves, V. H. Menezes da Silva
ChemPhysChem, 27, e202500637 (2026).
70
Theoretical Screening of the Water Oxidation Electrocatalytic Cycle Promoted by Single-Site Macrocyclic Copper(II) Complexes: Unraveling the Role of HPO42- Anion under Neutral Conditions
J. P. C. S. Neves, J. L. Nascimento, B. S. Sampaio, R. Rivelino, T. V. Alves, V. H. Menezes da Silva
ACS Organic & Inorganic Au, 6, 53 (2026).