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Artículos SCI



2023


Fotocatálisis Heterogénea: Aplicaciones - Nanotecnología en Superficies y Plasma

Mechanistic aspects of the reduction of rutile titanium dioxide and its Re-oxidation. Development and destruction of crystallographic shear structures

Bickley, RI; Garside, GR; González-Carreño, T; González-Elipe, AR; Navío, JA
Journal of Solid State Chemistry, 326 (2023) 124174

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A model is presented giving the mean dimensions of acicular octadecahedral microcrystallites of a rutile titanium dioxide powder. Reduction at 823 K, in conjunction with ESR, electrical conductivity and controlled re-oxidation has enabled the model to be applied to reduced microcrystallites. At 300 K they contain <0.1% of paramagnetic [Ti3+↑ VO: Ti3+] reduced edge sites and >99.9% of reduced spin-paired [Ti3+↑↓ Ti3+ VO:] sites. These sites are situated on the external crystal faces and on polygonal bulk crystallographic shear (CS) structures inclined to the microcrystal four-fold symmetry axis. CS structures are quantum-sized [Ti4O7VO:] environments which broaden the paramagnetic signals at 78 K. Temperature programmed reduction in H2(g) reveals atomic hydrogen as a precursor to CS structure formation via a lattice template formed on microcrystallite faces. Shear structures are oxidised on their polygonal perimeters at differing rates on the respective microcrystallite faces by anionic vacancy transfer from sub-surface regions.


Octubre, 2023 | DOI: 10.1016/j.jssc.2023.124174

Materiales Nanoestructurados y Microestructura - Materiales Ópticos Multifuncionales

Understanding the Problem of Hydrogen Storage Using a Demonstration: Coupling a Hydrogen Generator Based on the Hydrolysis of Sodium Borohydride to a Fuel-Cell Kit

Arzac, GM; Calvo, ME; Fernández, A
Journal of Chemical Education. 100 (2023) 4554-4558

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In the context of a green global energy paradigm, hydrogen (H-2) is a very promising energy carrier. In fuel cells, hydrogen can be used to generate electricity to drive an electric motor, producing water as its only byproduct. However, to implement hydrogen as an energy vector, developing methods for its production, storage, distribution, and use is essential. Sodium borohydride is a potential hydrogen source capable of releasing H-2 through catalytic hydrolysis. Herein, we present a demonstration that couples a hydrogen generator based on the hydrolysis of sodium borohydride to a commercial fuel-cell kit. The commercial fuel-cell kit operates using the hydrogen generated by an electrolyzer and includes a small fan to prove the successful generation of electricity. The performance of the fuel cell coupled with the borohydride-based reactor is compared to the performance achieved using the hydrogen produced by the electrolyzer. The borohydride-based reactor is designed to power the fan for 300 s and demonstrates efficient and safe hydrogen storage within a small volume of sodium borohydride. This study showcases the hydrogen cycle, the hydrogen storage problem, and the potential of sodium borohydride as a hydrogen storage material in a simple and useful way, contributing to science education and dissemination in the field of energy sustainability.


Octubre, 2023 | DOI: 10.1021/acs.jchemed.3c00590

Materiales de Diseño para la Energía y Medioambiente

Sustainable Integration of Zinc Oxide Nanoparticles: Enhancing Properties of Poly(ε-Caprolactone) Electrospun Nanofibers and Cast Films

Abdullah, JAA; Benítez, JJ; Guerrero, A; Romero, A
Coatings, 13 (2023) 1665

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This study investigated the impact of adding zinc oxide nanoparticles (ZnO-NPs) to electrospun membranes and cast films made of poly(epsilon-caprolactone) (PCL). The physicochemical, mechanical, and morphological properties of the samples were analyzed. Physicochemical parameters included water contact angle (WCA), water vapor transmission rate (WVTR), permeance, water vapor permeability (WVP), light transmission (T-600), and transparency (T). Mechanical properties, such as maximum stress (6(max)), elongation (epsilon(max)), and Young's modulus (MPa), were also evaluated. Morphological properties were analyzed in terms of thickness, dispersion, and surface roughness (measured by the arithmetic (Ra) and quadratic (Rq) averages). The crystallinity and melting point, as well as the functional DPPH center dot scavenging percentage (SP%), were also studied. The results showed that adding 1 wt% ZnO-NPs improved the water barrier properties of PCL membranes and films, increasing WCA by 1%-6% and decreasing WVTR by 11%-19%, permeance by 34%-20%, and WVP by 4%-11%, respectively. The T-600 values of PCL/ZnO-NPs membranes and films were 2-3 times lower than those of neat PCL samples, indicating improved optical properties. The mechanical properties of the composite membranes and films also improved, with 6(max) increasing by 56%-32% and Young's modulus increasing by 91%-95%, while epsilon(max) decreased by 79%-57%. The incorporation of ZnO-NPs also increased the thickness and surface roughness of the samples. The SP% of PCL/ZnO-NPs increased by almost 69%, demonstrating the beneficial effects of ZnO-NPs on the system. These findings suggest that incorporating ZnO-NPs into PCL membranes and films can enhance their properties, making them well suited for various applications, such as those within the realm of materials science and nanotechnology.


Octubre, 2023 | DOI: 10.3390/coatings13101665

Reactividad de Sólidos

Metal- based eggshell particles prepared via successive incipient wetness impregnation method as a promoted sorbent for CO2 capturing in the calcium looping process

Imani, M; Tahmasebpoor, M; Sanchez-Jimenez, PE
Journal of Environmental Chemical Engineering, 11 (2023) 110584

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Cyclic adsorption by using of bio-waste eggshell particles as a cheap, accessible and environmentally friendly CaCO3 source has been considered as one of the important methods to decrease or remove CO2 from the flue gas. However, deactivation of eggshell particles and CO2 capture capacity decaying with increasing the cycle's number remained as an important challenge. Using metal nitrates as one of the modification methods has been proposed by the researchers to overcome this problem. Current study investigates the influence of three metal nitrates of Al, La and Mg added to the eggshell particles via successive incipient wetness impregnation (SIWI) method to improve their adsorption performance. The TGA results at the end of the 20th carbonation/calcination cycle revealed a meaningful relationship between CaO molar conversion of eggshell modified with metal nitrates and their crystallite size as well as the surface area of the sorbents, so that the smaller the crystal size and the larger the surface area, the higher the molar conversion of CaO could be achieved. Due to the highest conversion obtained for Mg-containing sample, the effect of different weight percentages of this additive was also investigated. Results showed that 5 wt% MgO contained eggshell particles could be reported as the most outstanding sample for its improved molar conversion, capture capacity at the end of 20th carbonation/calcination cycle and BET surface area, which were 30.18%, 0.23 gr CO2/gr adsorbent and 3.5 m2/g while the corresponding amounts for raw eggshell were 17.26%, 0.11 gr CO2/gr adsorbent and 1.63 m2/g, respectively.


Octubre, 2023 | DOI: 10.1016/j.jece.2023.110584

Materiales de Diseño para la Energía y Medioambiente

Biodegradability Assessment of Prickly Pear Waste-Polymer Fibers under Soil Composting

Correa-Pacheco, ZN; Bautista-Baños, S; Benítez-Jiménez, JJ; Ortega-Gudiño, P; Cisneros-López, EO; Hernández-López, M
Polymers, 15 (2023) 4164

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Nowadays, solving the problems associated with environmental pollution is of special interest. Therefore, in this work, the morphology and thermal and mechanical properties of extruded fibers based on polylactic acid (PLA) and poly(butylene adipate-co-terephthalate) (PBAT) added to prickly pear flour (PPF) under composting for 3 and 6 months were evaluated. The highest weight loss percentage (92 +/- 7%) was obtained after 6-month degradation of the PLA/PBAT/PPF/CO/AA blend, in which PPF, canola oil (CO), and adipic acid (AA) were added. Optical and scanning electron microscopy (SEM) revealed structural changes in the fibers as composting time increased. The main changes in the absorption bands observed by Fourier transform infrared spectroscopy (FTIR) were related to the decrease in -C=O (1740 cm-1) and -C-O (1100 cm-1) groups and at 1269 cm-1, associated with hemicellulose in the blends with PPF. Differential scanning calorimetry (DSC) showed an increase in the cold crystallization and melting point with degradation time, being more evident in the fibers with PPF, as well as a decrease in the mechanical properties, especially Young's modulus. The obtained results suggest that PPF residues could promote the biodegradability of PLA/PBAT-based fiber composites.


Octubre, 2023 | DOI: 10.3390/polym15204164

 

 

 

 

 

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