Assessment of DFT functionals for structural determination of lanthanide(III) complexes using ligand field splitting

Lucca Blois, Renaldo T. Moura Jr., Ricardo L. Longo, Oscar L. Malta, Hermi F. Brito, Albano N. Carneiro Neto
2025, Journal of Computational Chemistry, 46, 2.

Closing the Loop: Greener and Efficient Hydrolytic Depolymerization for the Recycling of Polyesters Using Biobased Eutectic Solvents

Vinícius de Paula, Simão V. Pandeirada, Paulo J. A. Ribeiro-Claro, Armando J. D. Silvestre, Andreia F. Sousa
2025, ACS Sustainable Chemistry & Engineering.

Enhancing CO2 Capture Via Fast Microwave-Assisted Synthesis of the CALF-20 Metal–Organic Framework

Daniel Pereira, Mariana Sardo, Ricardo Vieira, Ildefonso Marín-Montesinos, Luís Mafra*
2025, Inorganic Chemistry, 67, 7.

High Emission Quantum Yields and Color-Tunable Properties of Ln-Chelates Embedded in PMMA

Aneta Lipa, Yen Hoang Pham, Albano N. Carneiro Neto, Viktor A. Trush, Huanrong Li, Oscar L. Malta, Volodymyr M. Amirkhanov, and Paula Gawryszewska
2025, Journal of Materials Chemistry C, 5.

Hydrogen-Bonding-Driven Design of Organic-Inorganic Hybrid Ferroelastics with Reversible Photoisomerization

Luis Verissimo; Zi-Luo Fang; Wei-Jian Xu; José M. G. Martinho; Wei Yuan; Wei-Xiong; Zhang, Andrei Kholkin, João Rocha
2025, INORGANIC CHEMISTRY (ACS), 64, 4, 2154–2163.

Pierceable, Storable, and Manipulable Liquid Capsules for Precise Monitoring and Efficient Cargo Transport in Biotechnological Advances

Pinho, A.R. , Wang C. , Gomes, M.C. , Mano, J.F.
2025, Advanced Functional Materials.

Predicting Adsorption Energies on MXene Surfaces Using Machine Learning to Enhance Catalyst Design for the Water–Gas Shift Reaction

Kais Iben Nassar, Tiago L. P. Galvão, José D. Gouveia, José R. B. Gomes
2025, The Journal of Physical Chemistry C.

Structural and Dynamic Heterogeneity of Deep Eutectic Solvents Composed of Choline Chloride and Ortho-Phenol Derivatives

D. Poe, D. O. Abranches, X. Wang, J. Klein, W. Dean, B. B. Hansen, B. Doherty, C. Fraenza, B. Gurkan, J. R. Sangoro, M. Tuckerman, S. G. Greenbaum, E. J. Maginn
2025, The Journal of Physical Chemistry B.

Theoretical Insights into the Vibrational Spectra and Chemical Bonding of Ln(III) Complexes with a Tripodal N4O3 Ligand Along the Lanthanide Series

Francielle C. Machado, Mateus Quintano, Carlos V. Santos-Jr, Albano N. Carneiro Neto, Elfi Kraka, Ricardo L. Longo, and Renaldo T. Moura Jr
2025, Physical Chemistry Chemical Physics, 4.

Understanding Redox Organic Behavior in Deep Eutectic Solvents: Considerations for Molecular Design

N. S. Sinclair, D. O. Abranches, R. F. Savinell, E. J. Maginn, J. S. Wainright
2025, Journal of The Electrochemical Society.

A high-speed method to obtain Ni-Zn ferrite nanoparticles by microwave hydrotalcite decomposition for magnetic applications

A. Lahlahi-Attalhaoui; J.G. Cuadra; S. Porcar; D. Fraga; I. Nebot-Diaz; Renan A.P. Ribeiro; J.G. Paulo; Juan B. Carda
2024, Journal of Alloys and Compounds, 1004, 175846.

Acidochromic Free-Standing Multilayered Chitosan-Pyranoflavylium/Alginate Membranes toward Food Smart Packaging Applications

Mariana Cunha, Victor de Freitas, João Borges, João F. Mano, João M. M. Rodrigues, Luís Cruz
2024, ACS Applied Polymers Materials.

Amniotic Membrane-Derived Multichannel Hydrogels for Neural Tissue Repair

Joana P.M. Sousa, Inês A. Deus, Cátia F. Monteiro, Catarina A. Custódio, João Gil, Lina Papadimitriou, Anthi Ranella, Emmanuel Stratakis, João F. Mano, Paula A.A.P. Marques
2024, ADVANCED HEALTHCARE MATERIALS, 13, 27.

Antitumoral Activity and Metabolic Signatures of Dichloroacetate, 6-Aminonicotinamide and Etomoxir in Breast-Tumor-Educated Macrophages.

Dias AS, Almeida CR, Helguero L, Duarte IF.
2024, Journal of Proteome Research.

Artificial Neural Networks for Predicting Optical Conversion Efficiency in Luminescent Solar Concentrators

P.S. André, L.M.S. Dias, S.F.H. Correia, A.N. Carneiro Neto, R.A.S. Ferreira
2024, Solar Energy.

Assessing Melting and Solid–Solid Transition Properties of Choline Chloride via Molecular Dynamics Simulations

G. B. Correa, D. O. Abranches, E. Marin-Rimoldi, Y. Zhang, E. J. Maginn, F. W. Tavares
2024, The Journal of Physical Chemistry Letters.

Biomaterials meet organ-on-chips – a perspective on tumor modeling

Cátia F. Monteiro, Inês A. Deus, Catarina A. Custódio, João F. Mano
2024, INTERNATIONAL MATERIALS REVIEWS, 70, 1.

Building the Young Program for IUPAC|CHAINS 2023

João Borges, Eva Meeus, Maximilian Menche, Fatima Mustafa, Koen Van den Helder
2024, ChemistryViews.

Carbon Dot-Laponite Hybrid Nanocomposites as Selective Turn-Off Sensors for Hg2+ Detection and Photoluminescence Quenching Mechanism

Bruno S. D. Onishi, Albano N. Carneiro Neto, Sidney J. L. Ribeiro
2024, ACS Omega, 9, 52.

Carbon Dots on Laponite Hybrid Nanocomposites: Solid-State Emission and Inter-aggregate Energy Transfer

Bruno S. D. Onishi, Albano N. Carneiro Neto, Ricardo Bortolleto-Santos, Valmor R. Masterlaro, Luís D. Carlos, Rute A. S. Ferreira, Sidney J. L. Ribeiro
2024, Nanoscale.