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1.
Biophys J ; 123(4): 451-463, 2024 Feb 20.
Artigo em Inglês | MEDLINE | ID: mdl-37924206

RESUMO

One of the earliest living systems was likely based on RNA ("the RNA world"). Mineral surfaces have been postulated to be an important environment for the prebiotic chemistry of RNA. In addition to adsorbing RNA and thus potentially reducing the chance of parasitic takeover through limited diffusion, minerals have been shown to promote a range of processes related to the emergence of life, including RNA polymerization, peptide bond formation, and self-assembly of vesicles. In addition, self-cleaving ribozymes have been shown to retain activity when adsorbed to the clay mineral montmorillonite. However, simulation studies suggest that adsorption to minerals is likely to interfere with RNA folding and, thus, function. To further evaluate the plausibility of a mineral-adsorbed RNA world, here we studied the effect of the synthetic clay montmorillonite K10 on the malachite green RNA aptamer, including binding of the clay to malachite green and RNA, as well as on the formation of secondary structures in model RNA and DNA oligonucleotides. We evaluated the fluorescence of the aptamer complex, adsorption to the mineral, melting curves, Förster resonance energy transfer interactions, and 1H-NMR signals to study the folding and functionality of these nucleic acids. Our results indicate that while some base pairings are unperturbed, the overall folding and binding of the malachite green aptamer are substantially disrupted by montmorillonite. These findings suggest that minerals would constrain the structures, and possibly the functions, available to an adsorbed RNA world.


Assuntos
Bentonita , RNA , Corantes de Rosanilina , Bentonita/química , RNA/química , Argila , Silicatos de Alumínio/química , Adsorção , Minerais/química
2.
Environ Sci Technol ; 58(9): 4415-4427, 2024 Mar 05.
Artigo em Inglês | MEDLINE | ID: mdl-38373279

RESUMO

Efficient mono- and divalent ion separation is pivotal for environmental conservation and energy utilization. Two-dimensional (2D) materials featuring interlayer nanochannels exhibit unique water and ion transport properties, rendering them highly suitable for water treatment membranes. In this work, we incorporated polydopamine/polyethylenimine (PDA/PEI) copolymers into 2D montmorillonite (MMT) nanosheet interlayer channels through electrostatic interactions and bioinspired bonding. A modified laminar structure was formed on the substrate surface via a straightforward vacuum filtration. The electrodialysis experiments reveal that these membranes could achieve monovalent permselectivity of 11.06 and Na+ flux of 2.09 × 10-8 mol cm-2 s-1. The enhanced permselectivity results from the synergistic effect of electrostatic and steric hindrance effect. In addition, the interaction between the PDA/PEI copolymer and the MMT nanosheet ensures the long-term operational stability of the membranes. Theoretical simulations reveal that Na+ has a lower migration energy barrier and higher migration rate for the modified MMT-based membrane compared to Mg2+. This work presents a novel approach for the development of monovalent permselective membranes.


Assuntos
Bentonita , Purificação da Água , Íons , Filtração , Purificação da Água/métodos
3.
Environ Sci Technol ; 58(22): 9669-9678, 2024 Jun 04.
Artigo em Inglês | MEDLINE | ID: mdl-38771965

RESUMO

In subsurface environments, Fe(II)-bearing clay minerals can serve as crucial electron sources for O2 activation, leading to the sequential production of O2•-, H2O2, and •OH. However, the observed •OH yields are notably low, and the underlying mechanism remains unclear. In this study, we investigated the production of oxidants from oxygenation of reduced Fe-rich nontronite NAu-2 and Fe-poor montmorillonite SWy-3. Our results indicated that the •OH yields are dependent on mineral Fe(II) species, with edge-surface Fe(II) exhibiting significantly lower •OH yields compared to those of interior Fe(II). Evidence from in situ Raman and Mössbauer spectra and chemical probe experiments substantiated the formation of structural Fe(IV). Modeling results elucidate that the pathways of Fe(IV) and •OH formation respectively consume 85.9-97.0 and 14.1-3.0% of electrons for H2O2 decomposition during oxygenation, with the Fe(II)edge/Fe(II)total ratio varying from 10 to 90%. Consequently, these findings provide novel insights into the low •OH yields of different Fe(II)-bearing clay minerals. Since Fe(IV) can selectively degrade contaminants (e.g., phenol), the generation of mineral Fe(IV) and •OH should be taken into consideration carefully when assessing the natural attenuation of contaminants in redox-fluctuating environments.


Assuntos
Radical Hidroxila , Minerais , Radical Hidroxila/química , Minerais/química , Ferro/química , Argila/química , Oxigênio/química , Peróxido de Hidrogênio/química , Oxirredução , Silicatos de Alumínio/química , Bentonita/química
4.
J Appl Microbiol ; 135(3)2024 Mar 01.
Artigo em Inglês | MEDLINE | ID: mdl-38458234

RESUMO

AIMS: Many countries are in the process of designing a deep geological repository (DGR) for long-term storage of used nuclear fuel. For several designs, used fuel containers will be placed belowground, with emplacement tunnels being backfilled using a combination of highly compacted powdered bentonite clay buffer boxes surrounded by a granulated "gapfill" bentonite. To limit the potential for microbiologically influenced corrosion of used fuel containers, identifying conditions that suppress microbial growth is critical for sustainable DGR design. This study investigated microbial communities in powdered and gapfill bentonite clay incubated in oxic pressure vessels at dry densities between 1.1 g cm-3 (i.e. below repository target) and 1.6 g cm-3 (i.e. at or above repository target) as a 1-year time series. RESULTS: Our results showed an initial (i.e. 1 month) increase in the abundance of culturable heterotrophs associated with all dry densities <1.6 g cm-3, which reveals growth during transient low-pressure conditions associated with the bentonite saturation process. Following saturation, culturable heterotroph abundances decreased to those of starting material by the 6-month time point for all 1.4 and 1.6 g cm-3 pressure vessels, and the most probable numbers of culturable sulfate-reducing bacteria (SRB) remained constant for all vessels and time points. The 16S rRNA gene sequencing results showed a change in microbial community composition from the starting material to the 1-month time point, after which time most samples were dominated by sequences associated with Pseudomonas, Bacillus, Cupriavidus, and Streptomyces. Similar taxa were identified as dominant members of the culture-based community composition, demonstrating that the dominant members of the clay microbial communities are viable. Members of the spore-forming Desulfosporosinus genus were the dominant SRB for both clay and culture profiles. CONCLUSIONS: After initial microbial growth while bentonite was below target pressure in the early phases of saturation, microbial growth in pressure vessels with dry densities of at least 1.4 g cm-3 was eventually suppressed as bentonite neared saturation.


Assuntos
Bentonita , Resíduos Radioativos , Resíduos Radioativos/análise , Argila , RNA Ribossômico 16S/genética
5.
Environ Res ; 241: 117544, 2024 Jan 15.
Artigo em Inglês | MEDLINE | ID: mdl-37944689

RESUMO

This study addresses the urgent need for practical solutions to industrial water contamination. Utilizing Algerian Bentonite as an adsorbent due to its regional prevalence, we focused on the efficiency of the Bentonite/Sodium dodecylbenzene sulfonate (SDBS) matrix in Methylene Blue (MB) removal. The zero-charge point and IR spectroscopy characterized the adsorbent. Acidic pH facilitated SDBS adsorption on Bentonite, achieving equilibrium in 30 min with a pseudo-second-order model. The UPAC and Freundlich model indicated a qmax of 25.97 mg/g. SDBS adsorption was exothermic at elevated temperatures. The loaded Bentonite exhibited excellent MB adsorption (pH 3-9) with PSOM kinetics. Maximum adsorption capacity using IUPAC and GILES-recommended isotherms was qmax = 23.54 mg/g. The loaded Bentonite's specific surface area was 70.01 m2/g, and the Sips model correlated well with experimental data (R2 = 0.98). This study highlights adsorption, mainly Bentonite/SDBS matrices, as a promising approach for remediating polluted areas by efficiently capturing and removing surfactants and dyes, contributing valuable insights to address industrial water contamination challenges.


Assuntos
Bentonita , Poluentes Químicos da Água , Bentonita/química , Azul de Metileno , Águas Residuárias , Poluentes Químicos da Água/análise , Concentração de Íons de Hidrogênio , Adsorção , Cinética , Água
6.
Environ Res ; 245: 118072, 2024 Mar 15.
Artigo em Inglês | MEDLINE | ID: mdl-38157971

RESUMO

Fish acute toxicity tests are commonly used in aquatic environmental risk assessments, being required in different international substances regulations. A general trend in the toxicity testing of nanomaterials (NMs) has been to use standardized aquatic toxicity tests. However, as these tests were primarily developed for soluble chemical, issues regarding particle dissolution, agglomeration or sedimentation during the time of exposure are not considered when reporting the toxicity of NMs. The aim of this study was to characterize the NM behaviour throughout the fish acute test and to provide criteria to assay the toxicity of nine NMs based on TiO2, ZnO, SiO2, BaSO4, bentonite, and carbon nanotubes, on rainbow trout following OECD Test Guideline (TG) nº203. Our results showed the importance of conducting a preliminary test (without fish) when working with NMs. They provide valuable information on, sample monitoring, agglomeration, sedimentation, dissolution, actual concentrations of NMs, needed to design the test. Among the NMs tested, only bentonite nanoparticles were stable during the 96-h pre-test and test in aquarium water. In contrast, the remaining NMs exhibited considerable loss and sedimentation within the first 24 h. The high sedimentation observed for almost all NMs highlights the need of consistently measuring the concentrations throughout the entire duration of the fish acute toxicity test to make reliable concentration-response relationships. Notable differences emerged in LC50 values when using actual concentrations as nominal concentrations overestimated concentrations by up to 85.6%. Among all NMs tested, only ZnO NMs were toxic to rainbow trout. A flow chart was specifically developed for OECD TG 203, aiding users in making informed decisions regarding the selection of test systems and necessary modifications to ensure accurate, reliable, and reusable toxicity data. Our findings might contribute to the harmonization of TG 203 improving result reproducibility and interpretability and supporting the development of read-across and QSAR models.


Assuntos
Nanoestruturas , Nanotubos de Carbono , Óxido de Zinco , Animais , Dióxido de Silício , Nanotubos de Carbono/toxicidade , Reprodutibilidade dos Testes , Bentonita , Nanoestruturas/química , Peixes
7.
Environ Res ; 248: 118218, 2024 May 01.
Artigo em Inglês | MEDLINE | ID: mdl-38266892

RESUMO

The contamination of water with organic pollutants such as dyes and phenols is a serious environmental problem, requiring effective treatment methods. In the present study, a novel nanocomposite was synthesized by intercalating graphene oxide and bentonite clay into MgFeAl-layered triple hydroxide (GO/BENT/LTH), which was characterized using different techniques. The adsorption efficacy of the GO/BENT/LTH nanocomposite was assessed via the removal of two harmful organic water pollutants, namely methyl orange (MO) and 2-nitrophenol (2NP). The obtained results revealed that the maximum adsorption capacities (qmax) of MO and 2NP reached 3106.3 and 2063.5 mg/g, respectively, demonstrating the excellent adsorption performance of the nanocomposite. Furthermore, this study examined the effects of contact time, initial MO and 2NP concentrations, pH, and temperature of the wastewater samples on the adsorptive removal of MO and 2NP by the GO/BENT/LTH nanocomposite. The pH, zeta potential, and FTIR investigations suggested the presence of more than one adsorption mechanism. Thermodynamic investigations elucidated the exothermic nature of the adsorption of MO and 2NP onto the GO/BENT/LTH nanocomposite, with MO adsorption being more sensitive to temperature change. Additionally, regeneration studies revealed a marginal loss in the MO and 2NP removal with the repetitive use of the GO/BENT/LTH nanocomposite, demonstrating its reusability. Overall, the findings of this study reveal the promise of the GO/BENT/LTH nanocomposite for effective water decontamination.


Assuntos
Poluentes Ambientais , Nanocompostos , Poluentes Químicos da Água , Bentonita/química , Adsorção , Poluentes Químicos da Água/análise , Água , Nanocompostos/química , Cinética , Concentração de Íons de Hidrogênio
8.
Environ Res ; 251(Pt 2): 118303, 2024 Jun 15.
Artigo em Inglês | MEDLINE | ID: mdl-38295978

RESUMO

A novel intercalated nanocomposite of mercapto-modified cellulose/bentonite (LCS-BE-SH) was synthesized by high-speed shearing method in one step at room temperature, and was applied to remove Cd from solution and remediate Cd-contaminated soil. Results revealed that cellulose long-chain molecules have intercalated into bentonite nanolayers and interlayer spacing was increased to 1.411 nm, and grafting -SH groups improved adsorption selectivity, which enabled LCS-BE-SH to have distinct capability of Cd adsorption (qmax = 147.21 mg/g). Kinetic and thermodynamics showed that Cd adsorption onto LCS-BE-SH was well fitted by pseudo-second-order and Langmuir adsorption isotherm. Characterizations of the adsorbents revealed that synergistic effect of complexation (e.g., CdS, CdO) and precipitation (e.g., Cd(OH)2, CdCO3) mechanism played a major role in Cd removal. In soil remediation, application of LCS-BE-SH was most effective (67.31 %) in Cd immobilization compared to the control (8.85 %), which reduced exchangeable Cd from 37.03 % to 11.44 %. Meanwhile, soil pH, soil organic matter, available phosphorus, and enzyme activities (catalase, urease, and dehydrogenase) were improved LCS-BE-SH treatment. The main immobilization mechanism in soil included complexation (e.g., CdS, CdO) and precipitation (e.g., Cd(OH)2, Cd-Fe-hydroxide). Overall, this work applied a promising approach for Cd removal in aqueous and Cd remediation in soil by using an effective eco-friendly LCS-BE-SH nanocomposites.


Assuntos
Bentonita , Cádmio , Celulose , Recuperação e Remediação Ambiental , Nanocompostos , Poluentes do Solo , Bentonita/química , Cádmio/química , Nanocompostos/química , Poluentes do Solo/química , Recuperação e Remediação Ambiental/métodos , Celulose/química , Adsorção
9.
Environ Res ; 247: 118193, 2024 Apr 15.
Artigo em Inglês | MEDLINE | ID: mdl-38220086

RESUMO

In the presented study, a novel polypyrrole-decorated bentonite magnetic nanocomposite (MBnPPy) was synthesized for efficient removal of both anionic methyl orange (MO) and cationic crystal violet (CV) dyes from contaminated water. The synthesis of this novel adsorbent involved a two-step process: the magnetization of bentonite followed by its modification through in-situ chemical polymerization. The adsorbent was characterized by SEM/EDX, TEM/SAED, BET, TGA/DTA-DTG, FTIR, VSM, and XRD studies. The investigation of the adsorption properties of MBnPPy was focused on optimizing various parameters, such as dye concentration, medium pH, dosage, contact time, and temperature. The optimal conditions were established as follows: dye concentration of Co (CV/MO) at 100 mg/L, MBnPPy dosage at 2.0 g/L, equilibrium time set at 105 min for MO and 120 min for CV, medium pH adjusted to 5.0 for MO dye and 8.0 for CV dye, and a constant temperature of 303.15 K. The different kinetic and isotherm models were applied to fit the experimental results, and it was observed that the Pseudo-2nd-order kinetics and Langmuir adsorption isotherm were the best-fitted models. The maximal monolayer adsorption capacities of the adsorbent were found to be 78.74 mg/g and 98.04 mg/g (at 303.15 K) for CV and MO, respectively. The adsorption process for both dyes was exothermic and spontaneous. Furthermore, a reasonably good regeneration ability of MBnPPy (>83.45%/82.65% for CV/MO) was noted for up to 5 adsorption-desorption cycles with little degradation. The advantages of facile synthesis, cost-effectiveness, non-toxicity, strong adsorption capabilities for both anionic and cationic dyes, and easy separability with an external magnetic field make MBnPPy novel.


Assuntos
Compostos Azo , Nanocompostos , Poluentes Químicos da Água , Corantes/química , Adsorção , Polímeros , Violeta Genciana/química , Bentonita/química , Pirróis , Água/química , Fenômenos Magnéticos , Poluentes Químicos da Água/análise , Concentração de Íons de Hidrogênio , Cinética
10.
Biotechnol Appl Biochem ; 71(1): 96-109, 2024 Feb.
Artigo em Inglês | MEDLINE | ID: mdl-37846152

RESUMO

The worldwide production of sparkling wines has been growing annually, driven by a market demand for high quality and more complex products. The present study aimed to evaluate the fermentation of Chardonnay must using two different Saccharomyces cerevisiae yeasts, either alone (from commercial brands A and B) or in combination with Torulaspora delbrueckii (ScA + Td and ScB + Td, respectively), as well as the addition of bentonite to the fermentation with ScA (ScA + Ben), to investigate their impact on aroma formation in sparkling base wine. Enological parameters, volatile composition, and sensory profile were evaluated. The results showed notable differences in total sulfur dioxide and volatile acidity among the S. cerevisiae strains. Moreover, the esters ethyl acetate, isoamyl acetate, hexyl acetate, and phenethyl acetate showed significant differences among treatments. Esters are recognized for their contribution to fruity and floral aromas, making them an essential part of the aromatic profile of wines. The descriptive analysis revealed that ScB + Td had the highest intensity of floral and tropical fruit notes, as well as aromatic clarity. The use of bentonite did not affect the aromatic composition or sensory profile of the wine. Therefore, the co-inoculation of S. cerevisiae with T. delbrueckii can lead to a base wine with a higher intensity of important volatile compounds and sensory attributes, providing an important alternative to produce winery products with a more complex aroma profile.


Assuntos
Torulaspora , Vinho , Vinho/análise , Saccharomyces cerevisiae , Odorantes , Bentonita , Fermentação , Acetatos/análise
11.
Ecotoxicol Environ Saf ; 280: 116533, 2024 Jul 15.
Artigo em Inglês | MEDLINE | ID: mdl-38850697

RESUMO

The widespread utilization of plastic products ineluctably leads to the ubiquity of nanoplastics (NPs), causing potential risks for aquatic environments. Interactions of NPs with mineral surfaces may affect NPs transport, fate and ecotoxicity. This study aims to investigate systematically the deposition and aggregation behaviors of carboxylated polystyrene nanoplastics (COOH-PSNPs) by four types of clay minerals (illite, kaolinite, Na-montmorillonite, and Ca-montmorillonite) under various solution chemistry conditions (pH, temperature, ionic strength and type). Results demonstrate that the deposition process was dominated by electrostatic interactions. Divalent cations (i.e., Ca2+, Mg2+, Cd2+, or Pb2+) were more efficient for screening surface negative charges and compressing the electrical double layer (EDL). Hence, there were significant increases in deposition rates of COOH-PSNPs with clay minerals in suspension containing divalent cations, whereas only slight increases in deposition rates of COOH-PSNPs were observed in monovalent cations (Na+, K+). Negligible deposition occurred in the presence of anions (F-, Cl-, NO3-, CO32-, SO42-, or PO43-). Divalent Ca2+ could incrementally facilitate the deposition of COOH-PSNPs through Ca2+-assisted bridging with increasing CaCl2 concentrations (0-100 mM). The weakened deposition of COOH-PSNPs with increasing pH (2.0-10.0) was primarily attributed to the reduce in positive charge density at the edges of clay minerals. In suspensions containing 2 mM CaCl2, increased Na+ ionic strength (0-100 mM) and temperature (15-55 ◦C) also favored the deposition of COOH-PSNPs. The ability of COOH-PSNPs deposited by four types of clay minerals followed the sequence of kaolinite > Na-montmorillonite > Ca-montmorillonite > illite, which was related to their structural and surface charge properties. This study revealed the deposition behaviors and mechanisms between NPs and clay minerals under environmentally representative conditions, which provided novel insights into the transport and fate of NPs in natural aquatic environments.


Assuntos
Cálcio , Argila , Poluentes Químicos da Água , Argila/química , Cálcio/química , Cálcio/análise , Poluentes Químicos da Água/química , Concentração Osmolar , Concentração de Íons de Hidrogênio , Silicatos de Alumínio/química , Poliestirenos/química , Temperatura , Minerais/química , Bentonita/química , Nanopartículas/química , Caulim/química , Eletricidade Estática
12.
Pestic Biochem Physiol ; 198: 105754, 2024 Jan.
Artigo em Inglês | MEDLINE | ID: mdl-38225096

RESUMO

Ralstonia solanacearum (R. solanacearum) is one of the most devastating pathogens in terms of losses in agricultural production. Bentonite (Bent) is a promising synergistic agent used in development of effective and environmentally friendly pesticides against plant disease. However, the synergistic mechanism of Bent nanoclays with benzothiazolinone (BIT) against R. solanacearum is unknown. In this work, acid-functionalized porous Bent and cetyltrimethylammonium bromide (CTAB) were employed as the core nanoclays, and BIT was loaded into the clay to form BIT-loaded CT-Bent (BIT@CT-Bent) for the control of bacterial wilt disease. BIT@CT-Bent exhibited pH-responsive release behavior that fit the Fickian diffusion model, rapidly releasing BIT in an acidic environment (pH = 5.5). The antibacterial effect of BIT@CT-Bent was approximately 4 times greater than that of the commercial product BIT, and its biotoxicity was much lower than that of BIT under the same conditions. Interestingly, R. solanacearum attracted BIT@CT-Bent into the nanocomposites and induced cytoplasmic leakage and changes in membrane permeability, indicating an efficient and synergistic bactericidal effect that rapidly reduced bacterial density. In addition, BIT@CT-Bent significantly inhibited R. solanacearum biofilm formation and swimming activity, by suppressing the expression of phcA, solR and vsrC. Indeed, exogenous application of BIT@CT-Bent significantly suppressed the virulence of R. solanacearum on tobacco plants, with control effect of 75.48%, 72.08% and 66.08% at 9, 11 and 13 days after inoculation, respectively. This study highlights the potential of using BIT@CT-Bent as an effective, eco-friendly bactericide to control bacterial wilt diseases and for the development of sustainable crop protection strategies.


Assuntos
Bentonita , Ralstonia solanacearum , Bentonita/farmacologia , Bentonita/metabolismo , Antibacterianos/farmacologia , Virulência , Concentração de Íons de Hidrogênio , Ralstonia solanacearum/metabolismo , Doenças das Plantas/prevenção & controle , Doenças das Plantas/microbiologia
13.
Chem Biodivers ; 21(4): e202301899, 2024 Apr.
Artigo em Inglês | MEDLINE | ID: mdl-38345198

RESUMO

This study presents the fabrication of a novel porous composite of graphene oxide-montmorillonite (GO-MMT) through the modification of montmorillonite using the freeze-drying method for the purpose of Pb removal. The characterization of the GO-MMT composite was conducted using scanning electron microscopy, Fourier transform infrared spectrometry, and X-ray diffraction. The results from batch adsorption experiments revealed that the GO-MMT composite exhibited a superior capacity for Pb removal compared to MMT. Furthermore, a single factor experiment confirmed that the dosage of the GO-MMT composite or GO, pH, temperature, and reaction time all significantly influenced the adsorption of Pb by the GO-MMT composite, MMT, or GO. This superiority can be attributed to the presence of oxygen-containing functional groups, the site-blocking effect, and the ion exchange mechanism exhibited by the GO-MMT composite.


Assuntos
Grafite , Poluentes Químicos da Água , Bentonita/química , Chumbo , Adsorção , Grafite/química , Poluentes Químicos da Água/química
14.
Environ Toxicol ; 39(4): 2086-2091, 2024 Apr.
Artigo em Inglês | MEDLINE | ID: mdl-38100244

RESUMO

Turbidity can be a result of suspended natural particles, such as sediment, or anthropogenic particles such as microplastics. This study assessed whether Daphnia magna, a pelagic filter feeder known to ingest suspended particles, have an altered response to equally turbid environments caused by the presence of either suspended bentonite or suspended polyethylene microplastics. Compared to controls, daphnids exposed to suspended bentonite maintained their feeding efficiency and increased their digestive activity, as measured by mandibular movement, peristalsis, and expulsion, to pass bentonite through the digestive tract. The same effects were not seen in microplastic-exposed individuals, in which feeding efficiency was decreased and only peristaltic movement was increased but without a coordinated increase in expulsion, suggesting that microplastics do not have the same ability as bentonite to pass through the digestive tract. This study highlights the need to discern the identities of particulates contributing to turbid environments as different particles, even of the same size, can have different effects on filter feeders, which inherently ingest suspended particles.


Assuntos
Microplásticos , Poluentes Químicos da Água , Animais , Humanos , Plásticos , Daphnia magna , Bentonita , Daphnia/fisiologia , Poluentes Químicos da Água/toxicidade , Polietileno , Sedimentos Geológicos
15.
Int J Mol Sci ; 25(3)2024 Jan 27.
Artigo em Inglês | MEDLINE | ID: mdl-38338882

RESUMO

Atrazine is one of the most widely used herbicide molecules in the triazine family. Despite its interdiction in the European Union in 2004, atrazine and its main degradation products remain among the most frequently found molecules in freshwater reservoirs in many European Union countries. Our study aims in obtaining insight into the desorption process of atrazine from the main soil absorbent material: clay. Constrained Molecular Dynamics simulations within the Density Functional Theory framework allow us to obtain a free energy desorption profile of atrazine from a Ca2+-montmorillonite surface. The results are interpreted in terms of atrazine inclination to the clay surface and moreover, in terms of hydration states of the cations present in the clay interlayer as well as the hydration state of the atrazine. The desorption mechanism is driven by atrazine alkyl groups and their sizes because of dispersion stabilizing effects. The highest barrier corresponds to the loss of the isopropyl interaction with the surface.


Assuntos
Atrazina , Herbicidas , Poluentes do Solo , Bentonita , Cálcio , Simulação de Dinâmica Molecular , Argila , Cálcio da Dieta , Adsorção
16.
Int J Mol Sci ; 25(13)2024 Jun 21.
Artigo em Inglês | MEDLINE | ID: mdl-38999945

RESUMO

Montmorillonite (MM) crystal nanoplates acquire anticancer properties when coated with the mitochondrial protein cytochrome c (cytC) due to the cancer cells' capability to phagocytize cytC-MM colloid particles. The introduced exogenous cytC initiates apoptosis: an irreversible cascade of biochemical reactions leading to cell death. In the present research, we investigate the organization of the cytC layer on the MM surface by employing physicochemical and computer methods-microelectrophoresis, static, and electric light scattering-to study cytC adsorption on the MM surface, and protein electrostatics and docking to calculate the local electric potential and Gibbs free energy of interacting protein globules. The found protein concentration dependence of the adsorbed cytC quantity is nonlinear, manifesting a positive cooperative effect that emerges when the adsorbed cytC globules occupy more than one-third of the MM surface. Computer analysis reveals that the cooperative effect is caused by the formation of protein associates in which the cytC globules are oriented with oppositely charged surfaces. The formation of dimers and trimers is accompanied by a strong reduction in the electrostatic component of the Gibbs free energy of protein association, while the van der Waals component plays a secondary role.


Assuntos
Bentonita , Citocromos c , Eletricidade Estática , Citocromos c/química , Citocromos c/metabolismo , Bentonita/química , Adsorção , Animais , Propriedades de Superfície , Simulação de Acoplamento Molecular , Termodinâmica , Silicatos de Alumínio
17.
J Environ Manage ; 358: 120894, 2024 May.
Artigo em Inglês | MEDLINE | ID: mdl-38643621

RESUMO

Discharging improperly treated oily-produced water (OPW) into the environment can have significant negative impacts on environmental sustainability. It can lead to pollution of water sources, damage to aquatic ecosystems and potential health hazards for individuals living in the affected areas. Ceramic hollow fiber membrane (CHFM) technology is one of the most effective OPW treatment methods for achieving high oil removal efficiency while maintaining membrane water permeability. In this study, low-cost calcium bentonite hollow fiber membranes (CaB-HFMs) were prepared from high-alumina calcium bentonite clay with various preparation parameters, including calcium bentonite content, sintering temperature, air gap distance and bore fluid rate. The prepared CaB-HFMs were then subjected to characterization using scanning electron microscopy (SEM), a three-point bending test, porosity, average pore size, hydraulic resistance and flux recovery ratio (FRR) analysis. Statistical analysis employing central composite design (CCD) assessed the interaction between the parameters and their effect on CaB-HFM water permeability and oil removal efficiency. Higher ceramic content and sintering temperature led to reduced porosity, smaller pore size and higher mechanical strength. In contrast, increasing the air gap distance and bore fluid rate exhibit different trends, resulting in higher porosity and pore size, along with weaker mechanical strength. Other than that, all of the CaB-HFMs displayed low hydraulic resistance (<0.01 m2 h.bar/L) and high FRR value (up to 95.2%). Based on CCD, optimal conditions for CaB-HFM were determined as follows: a calcium bentonite content of 50 wt.%, a sintering temperature of 1096 °C, an air gap distance of 5 cm and a bore fluid rate of 10 mL/min, with the desirability value of 0.937. Notably, the optimized CaB-HFMs demonstrated high oil removal efficiency of up to 99.7% with exceptional water permeability up to 535.2 L/m2.h.bar. The long-term permeation study also revealed it was capable of achieving a high average water permeation and a stable oil rejection performance of 522.15 L/m2.h.bar and 99.8%, respectively, due to their inherent hydrophilic and antifouling characteristics, making it practical for OPW treatment application.


Assuntos
Bentonita , Bentonita/química , Salinidade , Permeabilidade , Cálcio/química , Membranas Artificiais
18.
J Environ Manage ; 351: 119668, 2024 Feb.
Artigo em Inglês | MEDLINE | ID: mdl-38056333

RESUMO

Laying hen manure (LHM) is a major source of pollution due to its high nitrogen (N) and moisture content (MC). Therefore, reducing the MC of LHM is necessary to retain its recyclable value and reduce environmental pollution. One effective way is by incorporating sodium bentonite (SB) and wheat straw (WS) as amendments in the LHM. This work aimed to optimize the drying conditions of LHM and investigate the effect of SB and WS utilization on the dehydration rate, reduction of crude protein (CP), and reduction of ammonium-N (N [Formula: see text] -N). The response surface methodology (RSM) was used to optimize these processes. For this purpose, two sets of experiments (drying of LHM with and without SB and Ws) were designed. The independent parameters were air temperature (70, 80, and 90 °C), air velocity (1, 1.5, and 2 m s-1), layer thickness (5, 10, and 15 mm), SB (2%, 4%, and 6%), and WS (3%, 7.5%, and 12%). The results indicated that temperature and WS had the most significant influence on all responses. To maximize the dehydration rate and minimize the reduction of CP and N [Formula: see text] -N, the optimal conditions were a temperature of 78 °C, air velocity of 1 m s-1, and layer thickness of 5 mm in the first set of experiments, and a temperature of 80 °C, air velocity of 1.5 m s-1, layer thickness of 11 mm, 6% SB, and 12% WS in the second set of experiments. Under the optimum conditions, LHM treated with 6% SB and 12% WS retained 10% more CP and 58% more N [Formula: see text] -N than untreated LHM. Therefore, according to the obtained results, SB and WS are recommended as additives to reduce the CP and N [Formula: see text] -N losses of LHM during the drying process.


Assuntos
Compostos de Amônio , Esterco , Animais , Feminino , Triticum , Bentonita , Galinhas , Desidratação , Sódio
19.
J Environ Manage ; 352: 120053, 2024 Feb 14.
Artigo em Inglês | MEDLINE | ID: mdl-38211429

RESUMO

The combination of chemical phosphorus (P) inactivation and submerged macrophyte transplantation has been widely used in lake restoration as it yields stronger effects than when applying either method alone. However, the dose effect of chemical materials on P inactivation when used in combination with submerged macrophytes and the influences of the chemicals used on the submerged macrophytes growth remain largely unknown. In this study, we investigated P inactivation in both the water column and the sediment, and the responses of submerged macrophytes to Lanthanum modified bentonite (LMB) in an outdoor mesocosm experiment where Vallisneria denseserrulata were transplanted into all mesocosms and LMB was added at four dosage levels, respectively: control (LMB-free), low dosage (570 g m-2), middle dosage (1140 g m-2), and high dosage (2280 g m-2). The results showed that the combination of LMB dosage and V. denseserrulata reduced TP in the water column by 32%-38% compared to V. denseserrulata alone, while no significant difference was observed among the three LMB treatments. Porewater soluble reactive P, two-dimensional diffusive gradient in thin films (DGT)-labile P concentrations, and P transformation in the 0-1 cm sediment layer exhibited similar trends along the LMB dosage gradient. Besides, LMB inhibited plant growth and reduced the uptake of mineral elements (i.e., calcium, manganese, iron, and magnesium) in a dosage-dependent manner with LMB. LMB may reduce plant growth by creating a P deficiency risk for new ramets and by interfering with the uptake of mineral elements. Considering both the dose effect of LMB on P inactivation and negative effect on macrophyte growth, we suggest a "small dosage, frequent application" method for LMB application to be used in lake restoration aiming to recover submerged macrophytes and clear water conditions.


Assuntos
Fósforo , Poluentes Químicos da Água , Bentonita , Lantânio , Poluentes Químicos da Água/análise , Lagos , Água
20.
J Environ Manage ; 353: 120213, 2024 Feb 27.
Artigo em Inglês | MEDLINE | ID: mdl-38295637

RESUMO

Contamination of heavy metals has always been a pressing concern. The dry-wet alternately treated carboxymethylcellulose bentonite (DW-CB) was successfully prepared by intercalating bentonite (BT) with carboxymethyl cellulose (CMC) obtained by solvent processes using enzymatically digested wastepaper as cellulosic raw material, and the adsorption capacity of Cu2+ on DW-CB in aqueous solution was investigated. A 98.18 ± 2.31 % removal efficiency was achieved by 4 g/L of DW-CB after 8 h in a solution containing 100 mg/L of Cu2+, which were 4.1 times and 1.5 times of that of BT and adsorbent prepared without alternating dry-wet process, respectively. The introduction of -COOH groups during the preparation of DW-CB enhanced the electrostatic interaction between DW-CB and Cu2+, which was the main driving force for Cu2+ removal. The pseudo-first-order kinetic model and Langmuir model better described the adsorption process and adsorption capacity of Cu2+ on DW-CB. DW-CB still showed high removal of Cu2+ (19.61 ± 0.99 mg/g) in the presence of multiple metal ions, while exhibiting the potential for removal of Zn2+, Mg2+ and K+, especially Mg2+ (22.69 ± 1.48 mg/g). However, the interactions of organics with Cu2+ severely affected the removal of Cu2+ by DW-CB (removal efficiency: 17.90 ± 4.17 % - 95.33 ± 0.27 %). In this study, an adsorbent with high targeted adsorption of Cu2+ was prepared by utilizing wastepaper and BT, which broadened the way of wastepaper resource utilization and had good economic and social benefits.


Assuntos
Metais Pesados , Poluentes Químicos da Água , Bentonita , Cobre/análise , Poluentes Químicos da Água/análise , Água , Cinética , Adsorção , Concentração de Íons de Hidrogênio
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