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1.
Chemosphere ; : 143356, 2024 Sep 18.
Artículo en Inglés | MEDLINE | ID: mdl-39303791

RESUMEN

Industrial and human activities have led to serious soil and water pollution. Traditional remediation techniques have problems such as high treatment costs and the tendency to cause secondary pollution. Soil minerals and humic matters are common active components in soils. Both play vital roles and are frequently bound together to form humic matters-mineral complexes, which are considered sustainable and eco-friendly materials for environmental remediation and improvement. However, due to the complexity of humic matters-mineral interactions and the wide variation in the removal of different pollutants, there is a lack of research in this area. This paper provides a comprehensive introduction and summary of the interaction mechanisms between humic matters and typical soil minerals such as layered phosphate minerals and iron oxides, and their applications in environmental remediation, especially for the treatment of heavy metals (lead, mercury, chromium and cadmium) and organic pollutants (antibiotics, pesticides and polycyclic aromatic hydrocarbons) in water and soil. The humic matters-mineral complex can reduce the toxicity and migration rate of pollutants through adsorption, electrostatic attraction, together with H-bonding and hydrophobic interactions, reducing the harm of these pollutants to soil and water environments and realizing the efficient remediation of soil and water environments. And compared with the traditional treatment technology, this method is more green and environmental protection, and the treatment cost is greatly reduced. Finally, the deficiencies of using humic matters-mineral complex to achieve soil and water remediation were summarized and also proposed directions for future endeavors as well as concrete measures.

2.
ACS Nano ; 18(22): 14377-14387, 2024 Jun 04.
Artículo en Inglés | MEDLINE | ID: mdl-38781118

RESUMEN

Liquid crystal wet-spun carbon nanotube fibers (CNTFs) offer notable advantages, such as precise alignment and scalability. However, these CNTFs usually suffer premature failure through intertube slippage due to the weak interfacial interactions between adjacent shells and bundles. Herein, we present a microwave (MW) welding strategy to enhance intertube interactions by partially carbonizing interstitial heterocyclic aramid polymers. The resulting CNTFs exhibit ultrahigh static tensile strength (6.74 ± 0.34 GPa) and dynamic tensile strength (9.52 ± 1.31 GPa), outperforming other traditional high-performance fibers. This work provides a straightforward yet effective approach to strengthening CNTFs for advanced engineering applications.

3.
Chemosphere ; 359: 142383, 2024 Jul.
Artículo en Inglés | MEDLINE | ID: mdl-38768785

RESUMEN

Minerals and organic matter are essential components of soil, with minerals acting as the "bone" and organic matter as the "skin". The interfacial interactions between minerals and organic matter result in changes in their chemical composition, structure, functional groups, and physical properties, possessing a significant impact on soil properties, functions, and biogeochemical cycles. Understanding the interfacial interactions of minerals and organic matter is imperative to advance soil remediation technologies and carbon targets. Consequently, there is a growing interest in the physicochemical identification of the interfacial interactions between minerals and organic matter in the academic community. This review provides an overview of the mechanisms underlying these interactions, including adsorption, co-precipitation, occlusion, redox, catalysis and dissolution. Moreover, it surveys various methods and techniques employed to characterize the mineral-organic matter interactions. Specifically, the up-to-date spectroscopic techniques for chemical information and advanced microscopy techniques for physical information are highlighted. The advantages and limitations of each method are also discussed. Finally, we outline future research directions for interfacial interactions and suggests areas for improvement and development of characterization techniques to better understand the mechanisms of mineral-organic matter interactions.


Asunto(s)
Minerales , Suelo , Minerales/química , Suelo/química , Adsorción , Compuestos Orgánicos/química , Oxidación-Reducción , Restauración y Remediación Ambiental/métodos , Contaminantes del Suelo/química , Contaminantes del Suelo/análisis
4.
Water Res ; 256: 121613, 2024 Jun 01.
Artículo en Inglés | MEDLINE | ID: mdl-38663210

RESUMEN

Microplastics (MPs) and Cu have been detected in drinking water distribution systems (DWDSs). Investigating MP effects on Cu adsorption by pipe scales and concomitant variations of pipe scales was critical for improving the water quality, which remained unclear to date. Therefore, polystyrene microplastics (PSMPs) were adopted for the model MPs to determine their effects on Cu fate and pipe scale stabilization, containing batch adsorption, metal speciation extraction, and Cu release experiments. Findings demonstrated that complexation and electrostatic interactions were involved in Cu adsorption on pipe scales. PSMPs contributed to Cu adsorption via increasing negative charges of pipe scales and providing additional adsorption sites for Cu, which included the carrying and component effects of free and adsorbed PSMPs, respectively. The decreased iron and manganese oxides fraction (45.57 % to 29.91 %) and increased organic fraction (48.51 % to 63.58 %) of Cu in pipe scales when PSMPs were coexisting illustrated that PSMPs had a greater affinity for Cu than pipe scales and thus influenced its mobility. Additionally, the release of Cu could be facilitated by the coexisted PSMPs, with the destabilization of pipe scales. This study was the first to exhibit that Cu fate and pipe scale stabilization were impacted by MPs, providing new insight into MP hazards in DWDSs.


Asunto(s)
Cobre , Agua Potable , Microplásticos , Poliestirenos , Contaminantes Químicos del Agua , Poliestirenos/química , Agua Potable/química , Cobre/química , Contaminantes Químicos del Agua/química , Adsorción , Abastecimiento de Agua , Coloides/química
5.
ACS Sens ; 9(5): 2558-2566, 2024 05 24.
Artículo en Inglés | MEDLINE | ID: mdl-38664913

RESUMEN

The noble metal-loaded strategy can effectively improve the gas-sensing performances of metal oxide sensors. However, the gas-solid interfacial interactions between noble metal-loaded sensing materials and gaseous species remain unclear, posing a significant challenge in correlating the physical and chemical processes during gas sensing. In this study, in situ diffuse reflectance infrared Fourier transform spectroscopy (DRIFTS) and in situ Raman spectroscopy were conducted to collaboratively investigate the interfacial interactions involved in the ethanol gas-sensing processes over Co3O4 and Ag-loaded Co3O4 sensors. In situ DRIFTS revealed differences in the compositions and quantities of sensing reaction products, as well as in the adsorption-desorption interactions of surface species, among Co3O4 and Ag-loaded Co3O4 materials. In parallel, in situ Raman spectroscopy demonstrated that the ethanol atmosphere can modulate the electron scattering of Ag-loaded Co3O4 materials but not of raw Co3O4. In situ experimental results revealed the intrinsic reason for the highly enhanced sensing performances of the Ag-loaded Co3O4 sensors toward ethanol gas, including a decreased optimal working temperature (from 250 to 150 °C), an improved gas response level (from 24 to 257), and accelerated gas recovery dynamics. This work provides an effective platform to investigate the interfacial interactions of sensing processes at the molecular level and further advances the development of high-performance gas sensors.


Asunto(s)
Cobalto , Etanol , Óxidos , Plata , Espectrometría Raman , Cobalto/química , Óxidos/química , Plata/química , Etanol/química , Etanol/análisis , Espectrometría Raman/métodos , Gases/química , Espectroscopía Infrarroja por Transformada de Fourier
6.
Small Methods ; : e2301458, 2024 Feb 07.
Artículo en Inglés | MEDLINE | ID: mdl-38326035

RESUMEN

The high thermal storage density of phase change materials (PCMs) has attracted considerable attention in solar energy applications. However, the practicality of PCMs is often limited by the problems of leakage, poor solar-thermal conversion capability, and low thermal conductivity, resulting in low-efficiency solar energy storage. In this work, a new system of MXene-integrated solid-solid PCMs is presented as a promising solution for a solar-thermal energy storage and electric conversion system with high efficiency and energy density. The composite system's performance is enhanced by the intrinsic photo-thermal behavior of MXene and the heterogeneous phase transformation properties of PCM molecular chains. The optimal composites system has an impressive solar thermal energy storage efficiency of up to 94.5%, with an improved energy storage capacity of 149.5 J g-1 , even at a low MXene doping level of 5 wt.%. Additionally, the composite structure shows improved thermal conductivity and high thermal cycling stability. Furthermore, a proof-of-concept solar-thermal-electric conversion device is designed based on the optimized M-SSPCMs and commercial thermoelectric generators, which exhibit excellent energy conversion efficiency. The results of this study highlight the potential of the developed PCM composites in high-efficiency solar energy utilization for advanced photo-thermal systems.

7.
J Colloid Interface Sci ; 659: 289-298, 2024 Apr.
Artículo en Inglés | MEDLINE | ID: mdl-38176238

RESUMEN

Liquid-infused surfaces (LISs) have attracted tremendous attention in recent years owing to their excellent surface properties, such as self-cleaning and anti-fouling. Understanding the effect of lubricant composition on LIS performance is of vital importance, which will help establish the criteria to choose suitable infusing lubricants for specific applications. In this work, the role of chemical composition of lubricant in the properties of LISs was investigated. The apparent water contact angle θapp was dependent on the temperature and beeswax/silicone oil ratio. Nevertheless, the trend of moving velocity of water drop on the tilted LISs did not follow that of θapp at 20 °C and 37 °C, which was attributed to the increased lubricant viscosity with beeswax/silicone oil ratio. At 60 °C, the drop velocity and θapp shared the similar variation trend with beeswax/silicone oil ratio, highlighting the significant role of chemistry of the components in beeswax. The alkanes and fatty acids promoted the drop movement, while the fatty acid esters impeded the movement. The interaction forces between water drop and lubricant surfaces were measured using atomic force microscopy. It was demonstrated that the interaction between water drop and lubricant was not the only factor to control the drop movement, while the interaction between lubricant and substrate as well as of lubricant itself also determined the movement. When the adhesions of water-lubricant and lubricant-substrate were similar for different lubricants, the influence of cohesion of lubricant became significant. This work provides useful insights into the fundamental understanding of the interfacial interactions of test drop, infusing lubricant and solid substrate of LISs, and the effect of infusing lubricant composition on the LIS performance.

8.
Small ; 20(22): e2309313, 2024 May.
Artículo en Inglés | MEDLINE | ID: mdl-38164816

RESUMEN

Mineralization capable of growing inorganic nanostructures efficiently, orderly, and spontaneously shows great potential for application in the construction of high-performance organic-inorganic composites. As a thermodynamically spontaneous solid-phase crystallization reaction involving dual organic and inorganic components, mineralization allows for the self-assembly of sophisticated and exclusive nanostructures within a polymer matrix. It results in a diversity of functions such as enhanced strength, toughness, electrical conductivity, selective permeability, and biocompatibility. While there are previous reviews discussing the progress of mineralization reactions, many of them overlook the significant benefits of interfacial regulation and functionalization that come from the incorporation of mineralized structures into polymers. Focusing on different means of assembly of mineralized nanostructures in polymer, the work analyzes their design principles and implementation strategies. Then, their different advantages and disadvantages are analyzed by combining nanostructures with organic substrates as well as involving the basis of different functionalizations. It is anticipated to provide insights and guidance for the future development of mineralized polymer composites and their application designs.

9.
J Colloid Interface Sci ; 660: 136-146, 2024 Apr 15.
Artículo en Inglés | MEDLINE | ID: mdl-38241862

RESUMEN

HYPOTHESIS: Ice mitigation has received increasing attention due to the severe safety and economic threats of icing hazards to modern industries. Slippery icephobic surface is a potential ice mitigation approach due to its ultra-low ice adhesion strength, great humidity resistance, and effective delay of ice nucleation. However, this approach currently has limited practical applications because of serious liquid depletion in the icing/de-icing process. EXPERIMENTS: A new strategy of phase change materials (PCM)-impregnation porous metallic structures (PIPMSs) was proposed to develop phase changeable icephobic surfaces in this study, and aimed to solve the rapid depletion via the phase changeable interfacial interactions. FINDINGS: Evaluation of surface icephobicity and interfacial analysis proved that the phase changeable surfaces (PIPMSs) worked as an effective and durable icephobic platform by significantly delaying ice nucleation, providing long-term humid tolerance, low ice adhesion strength of as-prepared samples (less than 5 kPa), and signally improved maintaining capacity of impregnated PCMs (less than 10 % depletion) after 50 icing/de-icing cycles. To explore the interfacial responses, phase change models consisting of the unfrozen quasi-liquid layer and solid lubricant layer at the ice/PIPMSs interfaces were established, and the involved icephobic mechanisms of PIPMSs were studied based on the analysis of interfacial interactions.

10.
Small ; 20(4): e2305870, 2024 Jan.
Artículo en Inglés | MEDLINE | ID: mdl-37705123

RESUMEN

All-inorganic cesium lead bromide quantum dots (CsPbBr3 -QD) compounds are potential candidates for optoelectronic devices, because of their excellent fluorescence luminescence and thermal stability. However, the many heterojunction interfaces and large band gap induce the low power conversion efficiency in the CsPbBr3 -QD heterojunction, limiting its practical applications. Hereby, in combination with the pressure regulation and TiO2 /CsPbBr3 -QD heterojunction, the interface interaction within the heterojunction can be enhanced and the band gap can be narrowed. The pressure-induced O─Ti─O bond softening and PbBr6 octahedron stiffening at the interface region significantly enhance the interface interactions that are favorable to the carrier transport. Compared with CsPbBr3 -QD, the atomic interaction between Pb and Br of TiO2 /CsPbBr3 -QD heterojunction can be dramatically enhanced at high pressures, leading to increased band gap narrowing rate by two times, which is useful to widen the absorption spectrum. The fluorescence intensity increases by two times. Compression increases the photocurrent and maintains it after the pressure is released, which is due to the enhanced interface interaction induced by the high pressure. The findings provide new opportunities to adjust the physical properties of perovskite heterogeneous structures, and have important applications in the field of new-generation photovoltaic devices.

11.
ChemSusChem ; 17(2): e202301001, 2024 Jan 22.
Artículo en Inglés | MEDLINE | ID: mdl-37743618

RESUMEN

The significant rise in end-of-life tires (ELTs) globally poses immediate environmental and human health risks. Therefore, to promote ELTs recycling and to reduce tire industry carbon emissions, herein we present a facile approach for fine-tuning the interfacial interactions between pyrolytic carbon black (P-CB) obtained from ELTs and natural rubber (NR) matrix using phosphonium-based ionic liquid (PIL). The reinforcing effect of PIL-activated P-CB was studied by replacing the furnace-grade carbon black (N330-CB) with varying PIL and P-CB loadings. Adding PIL improved the filler dispersion and the cross-linking kinetics with a substantially reduced zinc oxide (ZnO) loading. Considering the cross-linking and viscoelastic properties, it was concluded that the composite, P-CB/N330-CB-PIL (1.5)+ZnO (1) with half substitution of N330-CB with P-CB synergistically works with 1.5 phr PIL and 1 phr of ZnO resulting in improved dynamic-mechanical properties with a minimal loss tangent value at 60 °C (tanδ=0.0689) and improved glass transition temperature (Tg =-38 °C) compared to control composite. The significant drop (~29 % lower) in tanδ could reduce fuel consumption and related CO2 emissions. We envisage that this strategy opens an essential avenue for "Green Tire Technology" towards the substantial pollution abatement from ELTs and reduces the toxic ZnO.

12.
Polymers (Basel) ; 15(22)2023 Nov 18.
Artículo en Inglés | MEDLINE | ID: mdl-38006177

RESUMEN

We investigated the effect of nanoscale curvature on the structure of thermally equilibrated poly-3-hexylthiophene (P3HT) ultrathin films. The curvature-induced effects were investigated with synchrotron grazing incidence X-ray diffraction (GIXRD) and atomic force microscopy (AFM). Our results demonstrate that nanoscale curvature reduces the polymer crystalline fraction and the crystal length. The first effect is strongest for the lowest curvature and results in a decrease in the out-of-plane thickness of the polymer crystals. On the other hand, the crystal in-plane length decreases with the increase in substrate curvature. Finally, the semi-quantitative analysis of crystal anisotropy shows a marked dependence on the substrate curvature characterized by a minimum at curvatures between 0.00851 nm-1 and 0.0140 nm-1. The results are discussed in terms of a curvature-dependent polymer fraction, which fills the interstices between neighboring particles and cannot crystallize due to extreme space confinement. This fraction, whose thickness is highest at the lowest curvatures, inhibits the crystal nucleation and the out-of-plane crystal growth. Moreover, because of the adhesion to the curved portion of the substrates, crystals adopt a random orientation. By increasing the substrate curvature, the amorphous fraction is reduced, leading to polymer films with higher crystallinity. Finally, when the thickness of the film exceeds the particle diameter, the curvature no longer affects the crystal orientation, which, similarly to the flat case, is predominantly edge on.

13.
ACS Appl Mater Interfaces ; 15(37): 43580-43590, 2023 Sep 20.
Artículo en Inglés | MEDLINE | ID: mdl-37672761

RESUMEN

De novo embedding enzymes within reticular chemistry materials have shown the enhancement of physical and chemical stability for versatile catalytic reactions. Compared to metal-organic frameworks (MOFs), covalent organic frameworks (COFs) are usually considered to be the more superior host of enzymes because of their large channels with low diffusion barriers, outstanding chemical/thermal stability, and metal-free nature. However, detailed investigations on the comparison of COFs and MOFs in enhancing biocatalytic performance have not been explored. Here, we de novo encapsulated enzymes within two COFs via a mechanochemical strategy, which avoided the extreme synthetic conditions of COFs and highly maintained the biological activities of the embedded enzymes. The enzymes@COFs biocomposites exhibited a much higher activity (3.4-14.7 times higher) and enhanced stability than those in MOFs (ZIF-8, ZIF-67, HKUST-1, MIL-53, and CaBDC), and the rate parameter (kcat/Km) of enzyme@COFs was 41.3 times higher than that of enzyme@ZIF-8. Further explorations showed that the conformation of enzymes inside MOFs was disrupted, owing to the harmful interfacial interactions between enzymes and metal ions as confirmed by ATR-FTIR, fluorescence spectroscopy, and XPS data. In contrast, enzymes that were embedded in metal-free COFs highly preserved the natural conformation of free enzymes. This study provides a better understanding of the interfacial interactions between reticular supports and enzymes, which paves a new road for optimizing the bioactivities of immobilized enzymes.


Asunto(s)
Estructuras Metalorgánicas , Enzimas Inmovilizadas , Biocatálisis , Catálisis , Difusión
14.
Polymers (Basel) ; 15(17)2023 Aug 29.
Artículo en Inglés | MEDLINE | ID: mdl-37688209

RESUMEN

Quantification of the biodegradability of soil water superabsorbents is necessary for a reasonable prediction of their stability and functioning. A new methodological approach to assessing the biodegradability of these polymer materials has been implemented on the basis of PASCO (USA) instrumentation for continuous registration of kinetic CO2 emission curves in laboratory incubation experiments with various hydrogels, including the well-known trade brands Aquasorb, Zeba, and innovative Russian Aquapastus composites with an acrylic polymer matrix. Original kinetic models were proposed to describe different types of respiratory curves and calculate half-life indicators of the studied superabsorbents. Comparative analysis of the new approach with the assessment by biological oxygen demand revealed for the first time the significance of CO2 dissolution in the liquid phase of gel structures during their incubation. Experiments have shown a tenfold reduction in half-life up to 0.1-0.3 years for a priori non-biodegradable synthetic superabsorbents under the influence of compost extract. The incorporation of silver ions into Aquapastus innovative composites at a dose of 0.1% or 10 ppm in swollen gel structures effectively increases their stability, prolonging the half-life to 10 years and more, or almost twice the Western stability standard for polymer ameliorants.

15.
J Colloid Interface Sci ; 650(Pt B): 1525-1535, 2023 Nov 15.
Artículo en Inglés | MEDLINE | ID: mdl-37487283

RESUMEN

HYPOTHESIS: Conventional coating strategies and materials for bio-applications with protective, diagnostic, and therapeutic functions are commonly limited by their arduous preparation processes and lack of on-demand functionalities. Herein, inspired by the 'root-leaf' structure of grass, a series of novel polyacrylate-conjugated proteins can be engineered with sticky bovine serum albumin (BSA) protein as a 'root' anchoring layer and a multifunctional polyacrylate as a 'leaf' functional layer for the facile coating procedure and versatile surface functionalities. EXPERIMENTS: The engineered proteins were synthesized based on click chemistry, where the 'root' layer can universally anchor onto both organic and inorganic substrates through a facile dip/spraying method with excellent stability in harsh solution conditions, thanks to its multiple adaptive molecular interactions with substrates that further elucidated by molecular force measurements between the 'root' BSA protein and substrates. The 'leaf' conjugated-polyacrylates imparted coatings with versatile on-demand functionalities, such as resistance to over 99% biofouling in complex biofluids, pH-responsive performance, and robust adhesion with various nanomaterials. FINDINGS: By synergistically leveraging the universal anchoring capabilities of BSA with the versatile physicochemical properties of polyacrylates, this study introduces a promising and facile strategy for imparting novel functionalities to a myriad of surfaces through engineering natural proteins and biomaterials for biotechnical and nanotechnical applications.


Asunto(s)
Incrustaciones Biológicas , Materiales Biocompatibles Revestidos , Materiales Biocompatibles Revestidos/química , Albúmina Sérica Bovina/química , Propiedades de Superficie
16.
Small ; 19(44): e2303044, 2023 Nov.
Artículo en Inglés | MEDLINE | ID: mdl-37403301

RESUMEN

Lightweight porous hydrogels provide a worldwide scope for functional soft mateirals. However, most porous hydrogels have weak mechanical strength, high density (>1 g cm-3 ), and high heat absorption due to weak interfacial interactions and high solvent fill rates, which severely limit their application in wearable soft-electronic devices. Herein, an effective hybrid hydrogel-aerogel strategy to assemble ultralight, heat-insulated, and tough polyvinyl alcohol (PVA)/SiO2 @cellulose nanoclaws (CNCWs) hydrogels (PSCG) via strong interfacial interactions with hydrogen bonding and hydrophobic interaction is demonstrated. The resultant PSCG has an interesting hierarchical porous structure from bubble template (≈100 µm), PVA hydrogels networks introduced by ice crystals (≈10 µm), and hybrid SiO2 aerogels (<50 nm), respectively. PSCG shows unprecedented low density (0.27 g cm-3 ), high tensile strength (1.6 MPa) & compressive strength (1.5 MPa), excellent heat-insulated ability, and strain-sensitive conductivity. This lightweight porous and tough hydrogel with an ingenious design provides a new way for wearable soft-electronic devices.

17.
J Colloid Interface Sci ; 650(Pt A): 775-783, 2023 Nov 15.
Artículo en Inglés | MEDLINE | ID: mdl-37441970

RESUMEN

To gain a thorough understanding of interfacial behaviors such as adhesion and flocculation controlling membrane fouling, it is necessary to simulate the actual membrane surface morphology and quantify interfacial interactions. In this work, a new method integrating the rough membrane morphology reconstruction technology (atomic force microscopy (AFM) combining with triangulation technique), the surface element integration (SEI) method, the extended Derjaguin-Landau-Verwey-Overbeek (XDLVO) theory, the compound Simpson's approach, and the computer programming was proposed. This new method can exactly mimic the real membrane surface in terms of roughness and shape, breaking the limitation of previous fractal theory and Gaussian method where the simulated membrane surface is only statistically similar to the real rough surface, thus achieving a precise description of the interfacial interactions between sludge foulants and the real membrane surface. This method was then applied to assess the antifouling propensity of a polyvinylidene fluoride (PVDF) membrane modified with Ni-ZnO particles (NZPs). The simulated results showed that the interfacial interactions between sludge foulants in a membrane bioreactor (MBR) and the modified PVDF-NZPs membrane transformed from an attractive force to a repulsive force. The phenomenon confirmed the significant antifouling propensity of the PVDF-NZPs membrane, which is highly consistent with the experimental findings and the interfacial interactions described in previous literature, suggesting the high feasibility and reliability of the proposed method. Meanwhile, the original programming code of the quantification was also developed, which further facilitates the widespread use of this method and enhances the value of this work.

18.
Int J Pharm ; 642: 123181, 2023 Jul 25.
Artículo en Inglés | MEDLINE | ID: mdl-37364786

RESUMEN

As novel green solvents, deep eutectic solvent (DES) with distinct liquid properties has gained increasing interest in pharmaceutical fields. In this study, DES was firstly utilized for improving powder mechanical properties and tabletability of drugs, and the interfacial interaction mechanism was explored. Honokiol (HON), a natural bioactive compound, was used as model drug, and two novel HON-based DESs were synthesized with choline chloride (ChCl) and l-menthol (Men), respectively. The extensive non-covalent interactions were account for DES formation according to FTIR, 1H NMR and DFT calculation. PLM, DSC and solid-liquid phase diagram revealed that DES successfully in situ formed in HON powders, and the introduction of trace amount DES (99:1 w/w for HON-ChCl, 98:2 w/w for HON-Men) significantly improve mechanical properties of HON. Surface energy analysis and molecular simulation revealed that the introduced DES promoted the formation of solid-liquid interfaces and generation of polar interactions, which increase interparticulate interactions, thus better tabletability. Compared to nonionic HON-Men DES, ionic HON-ChCl DES exhibited better improvement effect, since their more hydrogen-bonding interactions and higher viscosity promote stronger interfacial interactions and adhesion effect. The current study provides a brand-new green strategy for improving powder mechanical properties and fills in the blank of DES application in pharmaceutical industry.


Asunto(s)
Disolventes Eutécticos Profundos , Lignanos , Humanos , Masculino , Solventes/química , Polvos , Colina/química
19.
Chemphyschem ; 24(16): e202300267, 2023 Aug 15.
Artículo en Inglés | MEDLINE | ID: mdl-37283005

RESUMEN

Interfacial interactions of protonated water clusters adsorbed at aromatic surfaces play an important role in biology, and in atmospheric, chemical and materials sciences. Here, we investigate the interaction of protonated water clusters ((H+ H2 O)n (where n=1-3)) with benzene (Bz), coronene (Cor) and dodecabenzocoronene (Dbc)). To study the structure, stability and spectral features of these complexes, computations are done using DFT-PBE0(+D3) and SAPT0 methods. These interactions are probed by AIM electron density topography and non-covalent interactions index (NCI) analyses. We suggest that the excess proton plays a crucial role in the stability of these model interfaces through strong inductive effects and the formation of Eigen or Zundel features. Also, computations reveal that the extension of the π-aromatic system and the increase of the number of water molecules in the H-bounded water network led to a strengthening of the interactions between the corresponding aromatic compound and protonated water molecules, except when a Zundel ion is formed. The present findings may serve to understand in-depth the role of proton localized at aqueous medium interacting with large aromatic surfaces such as graphene interacting with acidic liquid water. Besides, we give the IR and UV-Vis spectra of these complexes, which may help for their identification in laboratory.

20.
Small Methods ; : e2300261, 2023 May 31.
Artículo en Inglés | MEDLINE | ID: mdl-37256272

RESUMEN

Under the threat of energy crisis and environmental pollution, the technology for sustainable and clean energy extraction has received considerable attention. Owing to the intensive exploration of energy conversion strategies, expanded energy sources are successfully converted into electric energy, including mechanical energy from human motion, kinetic energy of falling raindrops, and thermal energy in the ambient. Among these energy conversion processes, charge transfer at different interfaces, such as solid-solid, solid-liquid, liquid-liquid, and gas-contained interfaces, dominates the power-generating efficiency. In this review, the mechanisms and applications of interfacial energy generators (IEGs) with different interface types are systematically summarized. Challenges and prospects are also highlighted. Due to the abundant interfacial interactions in nature, the development of IEGs offers a promising avenue of inexhaustible and environmental-friendly power generation to solve the energy crisis.

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