Showing results 27 to 46 of 49
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Issue Date | Title | Author(s) | Type | Access Type |
27-Jan-2021 | Multifunctionality in an Ion-Exchanged Porous Metal-Organic Framework | Vilela, Sérgio M. F.; Navarro, Jorge A. R.; Barbosa, Paula; Mendes, Ricardo F.; Pérez-Sánchez, Germán; Nowell, Harriott; Ananias, Duarte; Figueiredo, Filipe; Gomes, José R. B.; Tomé, João P. C.; Almeida Paz, Filipe A. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
27-Nov-2022 | Multiscale computational approaches toward the understanding of materials | Bordonhos, Marta; Galvão, Tiago L. P.; Gomes, José R. B.; Gouveia, José D.; Jorge, Miguel; Lourenço, Mirtha A. O.; Pereira, José M.; Pérez-Sánchez, Germán; Pinto, Moisés L.; Silva, Carlos M.; Tedim, João; Zêzere, Bruno | article | ![openAccess openAccess](/image/custom/openAccess.png) |
26-Apr-2016 | Multiscale model for the templated synthesis of mesoporous silica: the essential role of silica oligomers | Pérez-Sánchez, Germán; Chien, Szu-Chia; Gomes, José R. B.; Cordeiro, M. Natália D. S.; Auerbach, Scott M.; Monson, Peter A.; Jorge, Miguel | article | ![openAccess openAccess](/image/custom/openAccess.png) |
Jan-2020 | MXenes as promising catalysts for water dissociation | Gouveia, José Daniel; Gomes, José R. B.; Illas, Francesc; Viñes, Francesc; Morales-García, Ángel | article | ![openAccess openAccess](/image/custom/openAccess.png) |
May-2020 | MXenes atomic layer stacking phase transitions and their chemical activity consequences | Gouveia, José D.; Viñes, Francesc; Illas, Francesc; Gomes, José R. B. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
23-Aug-2022 | MXenes à la Carte: Tailoring the Epitaxial Growth Alternating Nitrogen and Transition Metal Layers | Gouveia, José D.; Morales-García, Ángel; Viñes, Francesc; Gomes, José R. B.; Illas, Francesc | article | ![embargoedAccess embargoedAccess](/image/custom/embargoedAccess.png) |
9-Feb-2024 | Natural Polymer-Polyphenol Bioadhesive Coacervate with Stable Wet Adhesion, Antibacterial Activity, and On-Demand Detachment | Sacramento, Margarida M. A.; Oliveira, Mariana B.; Gomes, José R. B.; Borges, João; Freedman, Benjamin R.; Mooney, David J.; Rodrigues, João M. M.; Mano, João F. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
24-Nov-2021 | New force-field for organosilicon molecules in the liquid phase | Jorge, Miguel; Milne, Andrew W.; Barrera, Maria Cecilia; Gomes, José R. B. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
2020 | Novel insights into biomass delignification with acidic deep eutectic solvents: a mechanistic study of β-O-4 ether bond cleavage and the role of the halide counterion in the catalytic performance | Lopes, André Miguel da Costa; Gomes, José R. B.; Coutinho, João A. P.; Silvestre, Armando J. D. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
Feb-2023 | Salt effects on the solubility of aromatic and dicarboxylic amino acids in water | Aliyeva, Mehriban; Brandão, Paula; Gomes, José R. B.; Coutinho, João A. P.; Held, Christoph; Ferreira, Olga; Pinho, Simão P. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
9-Jun-2022 | Solubilities of Amino Acids in Aqueous Solutions of Chloride or Nitrate Salts of Divalent (Mg2+ or Ca2+) Cations | Aliyeva, Mehriban; Brandão, Paula; Gomes, José R. B.; Coutinho, João A. P.; Ferreira, Olga; Pinho, Simão P. | article | ![embargoedAccess embargoedAccess](/image/custom/embargoedAccess.png) |
25-Mar-2022 | Sticky-MARTINI as a reactive coarse-grained model for molecular dynamics simulations of silica polymerization | Carvalho, André P.; Santos, Sérgio M.; Pérez-Sánchez, Germán; Gouveia, Daniel; Gomes, José R. B.; Jorge, Miguel | article | ![openAccess openAccess](/image/custom/openAccess.png) |
28-Feb-2022 | Structural and energetic properties of vacancy defects in MXene surfaces | Gouveia, José D.; Gomes, José R. B. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
8-Sep-2022 | Surface and trapping energies as predictors for the photocatalytic degradation of aromatic organic pollutants | Dudziak, Szymon; Kowalkińska, Marta; Karczewski, Jakub; Pisarek, Marcin; Gouveia, José D.; Gomes, José R. B.; Zielińska-Jurek, Anna | article | ![openAccess openAccess](/image/custom/openAccess.png) |
15-Jul-2020 | The cation effect on the solubility of glycylglycine and N-acetylglycine in aqueous solution: experimental and molecular dynamics studies | Pérez-Sánchez, Germán; Santos, Yoselyn S.; Ferreira, Olga; Coutinho, João A. P.; Gomes, José R. B.; Pinho, Simão P. | article | ![embargoedAccess embargoedAccess](/image/custom/embargoedAccess.png) |
23-Jul-2022 | The determining role of Tx species in the catalytic potential of MXenes: Water adsorption and dissociation on Mo2CTx | Gouveia, José D.; Gomes, José R. B. | article | ![openAccess openAccess](/image/custom/openAccess.png) |
15-Jun-2022 | The dipole moment of alcohols in the liquid phase and in solution | Jorge, Miguel; Gomes, José R. B.; Barrera, Maria Cecilia | article | ![openAccess openAccess](/image/custom/openAccess.png) |
24-May-2012 | The origin of the LCST on the liquid-liquid equilibrium of thiophene with ionic liquids | Batista, Marta L. S.; Tomé, Luciana I. N.; Neves, Catarina M. S. S.; Rocha, Eugénio M.; Gomes, José R. B.; Coutinho, João A. P. | article | ![restrictedAccess restrictedAccess](/image/custom/restrictedAccess.png) |
1-Apr-2021 | The Ti2CO2 MXene as a nucleobase 2D sensor: a first-principles study | Gouveia, José D.; Novell-Leruth, Gerard; Viñes, Francesc; Illas, Francesc; Gomes, José R. B. | article | ![embargoedAccess embargoedAccess](/image/custom/embargoedAccess.png) |
14-Oct-2022 | Transition metal atom adsorption on the titanium carbide MXene: trends across the periodic table for the bare and O-terminated surfaces | Rocha, Henrique; Gouveia, José D.; Gomes, José R. B. | article | ![openAccess openAccess](/image/custom/openAccess.png) |