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Scientific Papers in SCI



2021


Química de Superficies y Catálisis

In Situ DRIFTS-MS Methanol Adsorption Study onto Supported NiSn Nanoparticles: Mechanistic Implications in Methanol Steam Reforming

Bobadilla, LF; Azancot, L; Ivanova, S; Delgado, JJ; Romero-Sarria, F; Centeno, MA; Roger, AC
Nanomaterials, 11 (2021) 3234

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Methanol adsorption over both supported NiSn Nps and analogous NiSn catalyst prepared by impregnation was studied by in situ diffuse reflectance infrared Fourier transform spectroscopy (DRIFTS) to gain insights into the basis of hydrogen production from methanol steam reforming. Different intermediate species such as methoxides with different geometry (bridge and monodentate) and formate species were identified after methanol adsorption and thermal desorption. It is proposed that these species are the most involved in the methanol steam reforming reaction and the major presence of metal-support interface sites in supported NiSn Nps leads to higher production of hydrogen. On the basis of these results, a plausible reaction mechanism was elucidated through the correlation between the thermal stability of these species and the evolution of the effluent gas released. In addition, it was demonstrated that DME is a secondary product generated by condensation of methoxides over the acid sites of alumina support in an acid-catalyzed reaction.


December, 2021 | DOI: 10.3390/nano11123234

Materiales de Diseño para la Energía y Medioambiente

Mechanical Performances of Isolated Cuticles Along Tomato Fruit Growth and Ripening

Benitez, JJ; Guzman-Puyol, S; Vilaplana, F; Heredia-Guerrero, JA; Dominguez, E; Heredia, A
Frontiers in Chemistry, 12 (2021) 787839

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The cuticle is the most external layer that protects fruits from the environment and constitutes the first shield against physical impacts. The preservation of its mechanical integrity is essential to avoid the access to epidermal cell walls and to prevent mass loss and damage that affect the commercial quality of fruits. The rheology of the cuticle is also very important to respond to the size modification along fruit growth and to regulate the diffusion of molecules from and toward the atmosphere. The mechanical performance of cuticles is regulated by the amount and assembly of its components (mainly cutin, polysaccharides, and waxes). In tomato fruit cuticles, phenolics, a minor cuticle component, have been found to have a strong influence on their mechanical behavior. To fully characterize the biomechanics of tomato fruit cuticle, transient creep, uniaxial tests, and multi strain dynamic mechanical analysis (DMA) measurements have been carried out. Two well-differentiated stages have been identified. At early stages of growth, characterized by a low phenolic content, the cuticle displays a soft elastic behavior. Upon increased phenolic accumulation during ripening, a progressive stiffening is observed. The increment of viscoelasticity in ripe fruit cuticles has also been associated with the presence of these compounds. The transition from the soft elastic to the more rigid viscoelastic regime can be explained by the cooperative association of phenolics with both the cutin and the polysaccharide fractions.


December, 2021 | DOI: 10.3389/fpls.2021.787839

Reactividad de Sólidos

Unravelling the optimization of few-layer graphene crystallinity and electrical conductivity in ceramic composites by Raman spectroscopy

Muñoz-Ferreiro, C; Lopez-Pernia, C; Gallardo-Lopez, A; Poyato, R
Journal of the European Ceramic Society, 41 (2021) 290-298

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Zirconia composites with few-layer graphene (FLG) were prepared by two powder processing routines-ultrasonic agitation or planetary ball milling-and spark plasma sintered at 1250 and 1300 degrees C. An in-depth study of the crystallinity of FLG, in terms of presence and nature of defects, was performed by Raman spectroscopy, revealing enhanced FLG crystallinity after sintering. This enhancement was more noticeable in the composites sintered at the highest temperature, with lower amount of structural defects and amorphous carbon. However, remaining amorphous carbon was detected in the composites prepared by planetary ball milling even after sintering at the highest temperature, resulting in lower electrical conductivities. Optimum results in terms of electrical conductivity were achieved for the composites prepared by ultrasonic agitation and sintered at 1300 degrees C, with electrical percolation limit below 2.5 vol% FLG and high electrical conductivity (678 S/m for 5 vol% FLG), as result of the enhanced FLG crystallinity after sintering.


December, 2021 | DOI: 10.1016/j.jeurceramsoc.2021.09.025

Reactividad de Sólidos

Advanced parametrisation of phase change materials through kinetic approach

Lizana, J; Perejon, A; Sanchez-Jimenez, PE; Perez-Maqueda, LA
Journal of Energy Storage, 44 (2021) 103441

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Phase change materials (PCM) have been widely investigated for heat storage and transfer applications. Numerous numerical simulation approaches have been proposed for modelling their behaviour and predicting their performance in thermal applications. However, simulation approaches do not consider the kinetics of the phase transition processes, compromising the accuracy of their predictions. The phase change is a kinetically driven process in which both the reaction rate and the reaction progress depend on the heating schedule. This work evaluates and parametrises the influence of kinetics in the melting and crystallisation behaviour of a well-known PCM, PEG1500, and compares potential discrepancies with common phase change parametrisation alternatives. The kinetic dependence was experimentally evaluated through differential scanning calorimetry (DSC). The kinetic parameters required for modelling the kinetics of the processes were determined by both model-free and model-fitting procedures following ICTAC (International Confederation for Thermal Analysis and Calorimetry) recommendations. Then, the phase transition was parametrised through a kinetic model and compared with three conventional phase transition models: linear without hysteresis, non-linear without hysteresis, and non-linear with hysteresis. The statistical comparison between models demonstrates the higher accuracy of the kinetic approach to correctly represent the partial enthalpy distribution of latent heat storage materials during alternative phase change rates, obtaining a coefficient of determination (R-2) of 0.80. On the other hand, the accuracy of kinetic-independent models is limited to the range from 0.40 to 0.61. The results highlight the high discrepancies of conventional models compared to the kinetic approach and provide criteria and guidelines for efficient kinetic modelling of phase change in heat transfer evaluations.


December, 2021 | DOI: 10.1016/j.est.2021.103441

Reactividad de Sólidos

Fabrication and characterization of FeCoNiCrMn,(Al) high entropy alloy based (Ti,Ta,Nb)(C,N) cermet

Real, C; Alcala, MD; Trigo, I; Fombella, I; Cordoba, JM
International Journal of Refractory Metals & Hard Materials, 101 (2021) 105694

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From nanostructured mechanically synthesized powder a set of FeCoNiCrMn,(Al) based (Ti,Ta,Nb)(C,N) cermets were fabricated and sintered by a pressureless procedure. Highly dense cermets were obtained, and the nature of chemical change, microstructure, mechanical properties and coarsening kinetic of ceramic phase were characterized by image analysis, microindentation, scanning electron microscopy and X-ray diffraction. The design of the material was performed using a set of three different chemical cermet composition and three different sintering temperatures, or comparative purposes.


December, 2021 | DOI: 10.1016/j.ijrmhm.2021.105694

 

 

 

 

 

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