Enhancing Thermomechanical Strength and Thermal Stability of Poly(dicyclopentadiene) Composites through Cost-Effective Fly Ash Reinforcement for Structural and Impact Applications.

Poly(dicyclopentadiene) (poly-DCPD) is a thermoset with potential for high-performance applications. In this research, epoxy resin was blended with different concentrations of fly ash class F particles at 0.0, 1.0, 10.0, and 50.0 wt.%, aiming to improve its use as a high-volume structural material by decreasing costs and reducing its negative environmental impact through using fly ash particles. A planetary Thinky mixer was used to initially mix the resin with the curing agent, followed by incorporating a Grubbs catalyst. The microstructures were analyzed using scanning electron microscopy (SEM), where particles were found to be homogeneously distributed over the polymer matrix. The thermomechanical behavior was evaluated via curing, compression, dynamic mechanical analysis (DMA), and thermo-gravimetric analysis (TGA). Nanoindentation tests were also conducted. Fly ash was found to decelerate the curing of the resin through the release of calcium ions that enhanced the exothermic reaction.

Self-Supported Spray-Coated NiFe-LDH Catalyst on a Stainless Steel Substrate for Efficient Oxygen Evolution Reaction.

In the quest for more efficient and cost-effective electrocatalytic systems, careful selection of catalysts and substrates plays a pivotal role. This study introduces an approach by synthesizing and depositing NiFe-layered double hydroxide (NiFe-LDH) catalysts on commercial AISI 304 substrates by using a low-temperature spray-coating technique. Through systematic investigations, the influence of processing conditions, such as the synthesis, ultrasonic power for having a stable nanoparticle's dispersion, and spray cycle optimization on the electrochemical and morphological properties of the coatings, is thoroughly explored. The results showcase exceptional catalytic performance, achieving an overpotential of 230 mV at 10 mA/cm2, with enhanced stability even at high current densities of 500 mA/cm2. The study highlights the significance of meticulous processing optimization and presents a scalable methodology that holds great potential for developing catalysts for oxygen evolution reactions (OER) and facilitates their integration into industrial processes.

Nonlinear Two-Photon Absorption in the Near-Infrared Band for Lead Bromide Perovskite Films Using an F-Scan Nonlinear Spectrometer.

An F-scan nonlinear spectrometer is used to measure the two-photon absorption coefficient for CH3NH3PbBr3 perovskite films from 690 to 995 nm. This spectrometer uses an electrically focused tunable lens and a tunable femtosecond-pulse laser (Mai Tai-HP) with a resolution of 5 nm. Two-band models and saturation irradiance corrections are used to fit the experimental data. The nonlinear absorption in this wavelength range is of the order of cm/MW. We found that the best agreement between the experimental data, the reported values in the literature, and the theoretical model is obtained for an extended two-band model with irradiance saturation correction.

Unravelling the Photocatalytic Behavior of All-Inorganic Mixed Halide Perovskites: The Role of Surface Chemical States.

Within the most mesmerizing materials in the world of optoelectronics, mixed halide perovskites (MHPs) have been distinguished because of the tunability of their optoelectronic properties, balancing both the light-harvesting efficiency and the charge extraction into highly efficient solar devices. This feature has drawn the attention of analogous hot topics as photocatalysis for carrying out more efficiently the degradation of organic compounds. However, the photo-oxidation ability of perovskite depends not only on its excellent light-harvesting properties but also on the surface chemical environment provided during its synthesis. Accordingly, we studied the role of surface chemical states of MHP-based nanocrystals (NCs) synthesized by hot-injection (H-I) and anion-exchange (A-E) approaches on their photocatalytic (PC) activity for the oxidation of ß-naphthol as a model system. We concluded that iodide vacancies are the main surface chemical states that facilitate the formation of superoxide ions, O2●-, which are responsible for the PC activity in A-E-MHP. Conversely, the PC performance of H-I-MHP is related to the appropriate balance between band gap and a highly oxidizing valence band. This work offers new insights on the surface properties of MHP related to their catalytic activity in photochemical applications.

Hidden energy levels? Carrier transport ability of CdS/CdS1-xSex quantum dot solar cells impacted by Cd-Cd level formation.

In quantum dot sensitized solar cells (QDSSC), a cascade energy level structure controlled by assembly of cadmium-chalcogenide quantum dots can remarkably improve the sunlight harvesting and charge carrier lifetime. Despite the advantages of using co-sensitizers, energy conversion efficiencies are still low. An increased understanding of the causes of the low photoconversion efficiency (PCE) will contribute to the development of a straightforward approach to improve solar cell performance by exploiting co-sensitization. Herein we discuss how an excess of cadmium causes structural disorder and defect levels impacting the PCE of QDSSC devices. Thus, outer CdS1-xSex/inner CdS QD-co-sensitized B,N,F-co-doped-TiO2 nanotubes (BNF-TNT) were prepared. Chalcogenides were deposited by the SILAR method on BNF-TNT, varying the load of CdS as the inner sensitizer, while for CdS1-xSex, five SILAR cycles were used (5-CdS1-xSex), controlling the nominal S/Se molar ratio of the ternary alloy. Cd defects named as Cd-Cd energy levels were observed during CdS sensitization. Although incorporation of outer CdS1-xSex provides a tunable band gap to achieve good band alignment for carrier separation, Cd-Cd energy levels in the sensitizers act as recombination centers, limiting the overall electron flow at the BNF-TNT/CdS/CdS1-xSex interface. A maximum PCE of 2.58% was reached under standard AM 1.5G solar illumination at 100 mW cm-2. Additional limitations of SILAR as a deposition strategy of QDs are also found to influence the PCE of QDSSC.

New nickel-based hybrid organic/inorganic metal halide for photovoltaic applications.

In this work, we have synthesized and fabricated solar cells with the hybrid metal halide compounds with the general formula ABX3, where the A cation is methylammonium, the B cation is nickel, and the X anion is chlorine or a mixture of chlorine and iodine. We obtained experimental evidence that this material is a semiconductor with an orthorhombic crystalline structure which pertains to the space group Cmcm. The bandgap can be modulated from 1.4 eV to 1.0 eV by changing the chlorine anion to iodine. Therefore, we were able to obtain solar cells with efficiencies up to 0.16% with the CH3NH3NiCl2I composition. We have also studied by means of first-principles calculations, taking into account van der Waals dispersive forces, the ground state properties of these materials such as their crystal structure and formation and decomposition energies. We have found that these energies are lowered by the lighter mass anion, and the calculated decomposition energies show that only CH3NH3NiCl3 is stable with respect to the most probable decomposition pathway. The electronic band structure and band edge alignments have been calculated using quasiparticle effects through the GW0 approximation; these materials show an indirect bandgap with the valence band maxima at -6.93 and -5.49 eV with respect to vacuum and the conduction band minima at -5.62 and -4.60 eV with respect to vacuum for CH3NH3NiCl3 and CH3NH3NiI3, respectively. This work provides a pathway to explore new hybrid A+B2+X3--type semiconductor materials.

Structural and Electrochemical Evaluation of Three- and Two-Dimensional Organohalide Perovskites and Their Influence on the Reversibility of Lithium Intercalation.

Organic-inorganic hybrid perovskite materials have recently been investigated in a variety of applications, including solar cells, light emitting devices (LEDs), and lasers because of their impressive semiconductor properties. Nevertheless, the perovskite structure has the ability to host extrinsic elements, making its application in the battery field possible. During the present study, we fabricated and investigated the electrochemical properties of three-dimensional (3D) methylammonium lead mixed-halide CH3NH3PbI3- xBr x and two-dimensional (2D) propylammonium-methlylammonium lead bromide (CH3NH3)2(CH3(CH2)2NH3)2Pb3Br10 hybrid perovskite thin films as electrode materials for Li-ion batteries. These electrodes were obtained by solution processing at 100 °C. CH3NH3PbBr3 achieved high discharge/charge capacities of ∼500 mA h g-1 /160 mA h g-1 that could account also for other processes taking place during the Li intercalation. It was also found that bromine plays an important role for lithium intercalation, while the new 2D (CH3NH3)2(CH3(CH2)2NH3)2Pb3Br10 with a layered structure allowed reversibility of the lithium insertion-extraction of 100% with capacities of ∼375 mA h g-1 in the form of a thin film. Results suggest that tuning the composition of these materials can be used to improve intercalation capacities, while modification from 3D to 2D layered structures contributes to improving lithium extraction. The mechanism of the lithium insertion-extraction may consist of an intercalation mechanism in the hybrid material accompanying the alloying-dealloying process of the Li xPb intermetallic compounds. This work contributes to revealing the relevance of both composition and structure of potential hybrid perovskite materials as future thin film electrode materials with high capacity and compositional versatility.

Simultaneous Top and Bottom Perovskite Interface Engineering by Fullerene Surface Modification of Titanium Dioxide as Electron Transport Layer.

Optimization of the interface between the electron transport layer (ETL) and the hybrid perovskite is crucial to achieve high-performance perovskite solar cell (PSC) devices. Fullerene-based compounds have attracted attention as modifiers on the surface properties of TiO2, the archetypal ETL in regular n-i-p PSCs. However, the partial solubility of fullerenes in the aprotic solvents used for perovskite deposition hinders its application to low-temperature solution-processed PSCs. In this work, we introduce a new method for fullerene modification of TiO2 layers derived from nanoparticles (NPs) inks. Atomic force microscopy characterization reveals that the resulting ETL is a network of TiO2-NPs interconnected by fullerenes. Interestingly, this surface modification enhances the bottom interface of the perovskite by improving the charge transfer as well as the top perovskite interface by reducing surface trap states enhancing the contact with the p-type buffer layer. As a result, rigid PSCs reached a 17.2% power conversion efficiency (PCE), while flexible PSCs exhibited a remarkable stabilized PCE of 12.2% demonstrating the potential application of this approach for further scale-up of PSC devices.

Optimization of the Ag/PCBM interface by a rhodamine interlayer to enhance the efficiency and stability of perovskite solar cells.

Effective control of the interface between the metal cathode and the electron transport layer (ETL) is critical for achieving high performance p-i-n planar heterojunction perovskite solar cells (PSCs). Several organic molecules have been explored as interlayers between the silver (Ag) electrode and the ETL for the improvement in the photovoltaic conversion efficiency (PCE) of p-i-n planar PSCs. However, the role of these organic molecules in the charge transfer at the metal/ETL interface and the chemical degradation processes of PSCs has not yet been fully understood. In this work, we systematically explore the effects of the interfacial modification of the Ag/ETL interface on PSCs using rhodamine 101 as a model molecule. By the insertion of rhodamine 101 as an interlayer between Ag and fullerene derivatives (PC60BM and PC70BM) ETLs improve the PCE as well as the stability of p-i-n planar PSCs. Atomic force microscopy (AFM) characterization reveals that rhodamine passivates the defects at the PCBM layer and reduces the band bending at the PCBM surface. In consequence, charge transfer from the PCBM towards the Ag electrode is enhanced leading to an increased fill factor (FF) resulting in a PCE up to 16.6%. Moreover, rhodamine acts as a permeation barrier hindering the penetration of moisture towards the perovskite layer as well as preventing the chemical interaction of perovskite with the Ag electrode. Interestingly, the work function of the metal cathode remains more stable due to the rhodamine incorporation. Consequently, a better alignment between the quasi-Fermi level of PCBM and the Ag work function is achieved minimizing the energy barrier for charge extraction. This work contributes to reveal the relevance of proper interfacial engineering at the metal-cathode/organic-semiconductor interface.

Self-Functionalization Behind a Solution-Processed NiOx Film Used As Hole Transporting Layer for Efficient Perovskite Solar Cells.

Fabrication of solution-processed perovskite solar cells (PSCs) requires the deposition of high quality films from precursor inks. Frequently, buffer layers of PSCs are formed from dispersions of metal oxide nanoparticles (NPs). Therefore, the development of trustable methods for the preparation of stable colloidal NPs dispersions is crucial. In this work, a novel approach to form very compact semiconducting buffer layers with suitable optoelectronic properties is presented through a self-functionalization process of the nanocrystalline particles by their own amorphous phase and without adding any other inorganic or organic functionalization component or surfactant. Such interconnecting amorphous phase composed by residual nitrate, hydroxide, and sodium ions, proved to be fundamental to reach stable colloidal dispersions and contribute to assemble the separate crystalline nickel oxide NPs in the final film, resulting in a very homogeneous and compact layer. A proposed mechanism behind the great stabilization of the nanoparticles is exposed. At the end, the self-functionalized nickel oxide layer exhibited high optoelectronic properties enabling perovskite p-i-n solar cells as efficient as 16.6% demonstrating the pertinence of the presented strategy to obtain high quality buffer layers processed in solution at room temperature.

ZrO2/TiO2 Electron Collection Layer for Efficient Meso-Superstructured Hybrid Perovskite Solar Cells.

Since the first reports of efficient organic-inorganic perovskite solar cells in 2012, an explosion of research activity has emerged around the world, which has led to a rise in the power conversion efficiencies (PCEs) to over 20%. Despite the impressive efficiency, a key area of the device which remains suboptimal is the electron extraction layer and its interface with the photoactive perovskite. Here, we implement an electron collection "bilayer" composed of a thin layer of zirconia coated with titania, sitting upon the transparent conductive oxide fluorine-doped tin oxide (FTO). With this double collection layer we have reached up to 17.9% power conversion efficiency, delivering a stabilized power output (SPO) of 17.0%, measured under simulated AM 1.5 sunlight of 100 mW cm-2 irradiance. Finally, we propose a mechanism of the charge transfer processes within the fabricated architectures in order to explain the obtained performance of the devices.

Definición de nanomateriales para Colombia / Definition of Nanomateriais for Colombia / Definição de nanomateriais para a Colômbia

Debido a la creciente producción y uso de nanomateriales para actividades de investigación y desarrollo en Colombia, es necesario establecer una definición del término nanomaterial que facilite la toma de decisiones en torno a iniciativas de carácter regulatorio y de normatividad. Se presenta la definición de nanomateriales para Colombia que ha adoptado el Consejo Nacional Asesor de Nanociencia y Nanotecnología adscrito a la Red Colombiana de Nanociencia y Nanotecnología.

Due to the increasing production and use of nanomaterials in research and development activities in Colombia, it is necessary to define the nanomaterial term in order to facilitate decision-making process regarding initiatives with a regulatory or normative character. This article presents the nanomaterials definition that has been adopted by the National Advisory Council for Nanoscience and Nanotechnology, a Colombian Network of Nanoscience and Nanotechnology.

Dada a crescente produção e utilização de nanomateriais para a pesquisa e desenvolvimiento na Colombia, é urgente estabelecer uma definição do termo de nanomaterial para facilitar a tomada de decisão sobre iniciativas na regulamentação e as leis. É apresentada uma definição de nanomateriais para a Colombia que aprovou o Conselho Consultivo Nacional de Nanociência e Nanotecnologia ligado à Rede Colombiana de Nanociência e Nanotecnologia.

Design of Super-Paramagnetic Core-Shell Nanoparticles for Enhanced Performance of Inverted Polymer Solar Cells.

Controlling the nature and transfer of excited states in organic photovoltaic (OPV) devices is of critical concern due to the fact that exciton transport and separation can dictate the final performance of the system. One effective method to accomplish improved charge separation in organic electronic materials is to control the spin state of the photogenerated charge-carrying species. To this end, nanoparticles with unique iron oxide (Fe3O4) cores and zinc oxide (ZnO) shells were synthesized in a controlled manner. Then, the structural and magnetic properties of these core-shell nanoparticles (Fe3O4@ZnO) were tuned to ensure superior performance when they were incorporated into the active layers of OPV devices. Specifically, small loadings of the core-shell nanoparticles were blended with the previously well-characterized OPV active layer of poly(3-hexylthiophene) (P3HT) and [6,6]-phenyl-C61-butyric acid methyl ester (PCBM). Upon addition of the core-shell nanoparticles, the performance of the OPV devices was increased up to 25% relative to P3HT-PCBM active layer devices that contained no nanoparticles; this increase was a direct result of an increase in the short-circuit current densities of the devices. Furthermore, it was demonstrated that the increase in photocurrent was not due to enhanced absorption of the active layer due to the presence of the Fe3O4@ZnO core-shell nanoparticles. In fact, this increase in device performance occurred because of the presence of the superparamagnetic Fe3O4 in the core of the nanoparticles as incorporation of ZnO only nanoparticles did not alter the device performance. Importantly, however, the ZnO shell of the nanoparticles mitigated the negative optical effect of Fe3O4, which have been observed previously. This allowed the core-shell nanoparticles to outperform bare Fe3O4 nanoparticles when the single-layer nanoparticles were incorporated into the active layer of OPV devices. As such, the new materials described here present a tangible pathway toward the development of enhanced design schemes for inorganic nanoparticles such that magnetic and energy control pathways can be tailored for flexible electronic applications.