Langmuir Isotherm Research Articles

Evaluation of optimized conditions for the adsorption of malachite green by SnO2-modified sugarcane bagasse biochar nanocomposites.

This work deals with the synthesis of SnO2-modified sugarcane bagasse biochar (SnO2-SBB) nanocomposites using an impregnation method. XRD, FTIR, SEM, and EDX analyses were used to characterize the produced nanocomposites. Several factors influencing the removal of malachite green from wastewater via the adsorption process were explored to maximize the effectiveness of this process. These factors included the different doses of nanocomposites, pH, temperature, contact time, etc. Studies on batch adsorption were conducted to examine the impact of operational parameters, such as contact time (5 to 30 minutes), adsorbent dosage (5 to 40 mg), pH (2 to 10), and temperature (303, 323, and 353 K), on the percentage of MG dye removal. The adsorption kinetics of MG dye over SnO2-SBB nanocomposites were evaluated with the aid of the Langmuir adsorption isotherm, which provided a good fit (R 2 = 0.99) for pseudo-second-order kinetics. The thermodynamic parameters revealed spontaneous and exothermic adsorption of MG dye over SnO2-SBB nanocomposites. A maximum adsorption capacity (q max) of 52.64 ± 0.03 for 0.3 SnO2-SBB and 73.86 ± 0.05 for 0.5 SnO2-SBB nanocomposites was observed. The newly synthesized SnO2-SBB nanocomposites showed negative zeta potential, which facilitated the adsorption of hydrated cationic dye molecules due to the electrostatic force of attraction.

Acid precipitation-hydrothermal synthesis of needle-like hydroxyapatite for protein adsorption from waste phosphogypsum

ABSTRACT In order to promote the high-value utilization of waste phosphogypsum (PG), hydroxyapatite was directly synthesized from PG by acid precipitation-hydrothermal method (PGHAP), which was used for the adsorption of bovine serum albumin (BSA) and lysozyme (LYS). The synthesized PGHAP was characterized by XRD, SEM, FTIR and BET, and the effects of various factors on protein adsorption capacity were studied. The results showed that PGHAP exhibits a clear needle-like morphology, high crystallinity, and an average size of about 200 nm. The pH had the greatest effect on the adsorption of protein, and the highest adsorption capacity was obtained at pH 4.0. In addition, the adsorption mechanism of protein on PGHAP was explored by adsorption kinetics and adsorption isotherm. The adsorption of protein on PGHAP conforms to the Intra-particle diffusion model kinetic model, the maximum adsorption capacity of protein on PGHAP can reach 31 mg/g, which is comparable to other adsorbents in this field. In addition, the adsorption behaviour of PGHAP on protein is more appropriately described by Langmuir isotherm model, which indicates that the binding site with uniform energy on the surface of PGHAP realizes the monolayer adsorption of protein. The main adsorption mechanisms are ion exchange, co-precipitation, complexation reaction and so on. Therefore, the needle-like PGHAP synthesized from waste PG is a protein adsorbent with industrial application potential.

Enhanced microplastics removal from sewage effluents via CTAB-modified magnetic biochar: Efficacy and environmental impact

Sewage treatment plants (STPs) are identified as a significant pathway of microplastics (MPs) re-entry into the environment through effluent discharge, thereby emphasizing the need for reliable and efficient treatment methods. This study investigated MPs removal from sewage effluents using cetyl trimethyl ammonium bromide (CTAB)-modified magnetic biochar (RH-MBC-CTAB) as an adsorbent. Biochars from different biomass were synthesized, surface modified, characterized, and compared for their MPs removal efficacy from aqueous matrices. Batch adsorption studies were initially conducted on synthetic water with 1 μm sized polystyrene (PS) MPs using different MP concentrations (1–10 mg/L) and varying adsorbent dosages (1–10 mg/50 mL) to assess the effect of different process parameters, viz. pH (2–10), humic acid (6–25 mg/L), and competitive ions (0.01–0.2 M). The maximum MPs removal (98%) was achieved at the favorable conditions: initial MPs concentration: 10 mg/L, RH-MBC-CTAB dose: 7 mg/50 mL, pH 4, mixing speed: 180 rpm, and contact time: 3 min. Electrostatic attraction and hydrogen bonding were likely to remove MPs while the MPs adsorption was best fitted by the pseudo-second-order kinetics model (R2 = 0.91) and Langmuir isotherm model (R2 = 0.94) with the maximum adsorption capacity of 247.52 mg/g. Further, the application of RH-MBC-CTAB on the real-time sewage effluents from sequencing batch reactor (SBR) and moving bed biofilm reactor (MBBR)-based STPs spiked with MPs showed up to 96% MPs removal. The reusability results revealed that developed RH-MBC-CTAB could maintain good stability for up to three reusability cycles, therefore offering extensive potential for the removal of MPs from sewage effluents.

Hydrothermal synthesis, characterization of Co3Sb4O6F6 and carbon doped Co3Sb4O6F6 and their application towards photocatalytic dye degradation, adsorption, catalytic Knoevenagel condensation and bacterial disinfection

Single crystals of Co3Sb4O6F6 have been grown by employing hydrothermal techniques. Table sugar was utilized to prepare carbon-doped Co3Sb4O6F6. The objective was to employ Co(II)-based metal oxyfluoride comprising a stereochemically active lone pair element (Sb3+) and its carbon-doped analogues for the multifunctional applications. The impact of carbon doping on Co3Sb4O6F6 has been evaluated towards the changes in photocatalytic, catalytic, and adsorbent efficiency. The changes in carbon percentage affect the physical and chemical properties of the host material. A larger percentage of carbon doping turns the photocatalytic ability of the host material into an adsorbent for the removal of dye. The single crystal X-ray diffraction study reveals that Co3Sb4O6F6 crystallizes into cubic symmetry. However, powder X-ray diffraction study reveals the structural transformation in the carbon-doped Co3Sb4O6F6. It also reduces the band gap energy of the host material, and 4 wt% C@Co3Sb4O6F6 turns out to be an efficient photocatalyst. Large-scale carbon doping (15 wt%) appears to be an effective strategy to increase the surface charge and BET surface area, as consequences adsorption property develops in 15 wt% C@Co3Sb4O6F6/H2O2 for the elimination of methylene blue (MB). This favourable chemical adsorption process occurs with large maximum adsorption capacity (qmax = 58.41169 mg g-1), as evident from the Langmuir adsorption isotherm. Scavenger experiment confirms that the photocatalytic activities of the as-synthesised compounds were triggered by the active participation of the hydroxyl radical (.OH). The catalytic efficiencies of both parent and doped compounds are also established for the solvent-free Knoevenagel condensation reaction with 90 % yield at moderate temperature. Bacterial disinfection studies by the ‘Disc diffusion method’ confirm that Co3Sb4O6F6 shows better efficiency than the carbon doped compound against both Gram-positive and Gram-negative bacteria.

Novel utilization exploration for the dephosphorization waste of Ca–modified biochar: enhanced removal of heavy metal ions from water

Phosphorus-modified biochar has been proven to enhance the precipitation and complexation of heavy metal ions from wastewater. However, the current modification methods require large amounts of exogenous P and have high energy consumption. Hence, this study proposes and analyzes a strategy integrating biochar production, phosphorus wastewater treatment, dephosphorization waste recovery, and heavy metal removal. “BC-Ca-P” was derived from Ca-modified biochar after phosphorus wastewater treatment. The adsorption of Pb(II) by BC-Ca-P followed the Langmuir isotherm and pseudo–second–order kinetic models. The maximum adsorption capability of 361.20 mg·g−1 at pH 5.0 for 2 h was markedly greater than that of external phosphorous-modified biochar. The adsorption mechanisms were dominated by chemical precipitation and complexation. Furthermore, density functional theory calculations indicated that oxygen-containing functional groups (P-O and C-O) contributed the most to the efficient adsorption of Pb(II) onto BC-Ca-P. To explore its practical feasibility, the adsorption performance of BC-Ca-P recovered from an actual environment was evaluated. The continuous-flow adsorption behavior was investigated and well-fitted utilizing the Thomas and Yoon–Nelson models. There was a negligible P leakage risk of BC-Ca-P during heavy metal treatment. This study describes a novel and sustainable method to utilize dephosphorization waste for heavy metal removal.Graphical

A highly efficient and environmentally friendly approach to utilizing Quercus suber pericarp subfractions to remove metallic cations from aqueous solutions

Increasing water contamination from metal cations is a significant environmental challenge for humans. This has sparked extensive research into the development of adsorbents with superior removal efficiencies. This study assessed the adsorption capacity of crude and lignocellulosic fractions obtained from the pericarp of Quercus suber acorns, specifically focusing on the removal of Pb(II), Cd(II), Ni(II), and Cu(II) ions from aqueous solutions. The lignocellulosic fraction was separated from the crude fraction after extraction of cell wall polysaccharides using water and alkaline solutions. Scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FTIR) were used to characterize the crude and lignocellulosic fractions. Data from equilibrium adsorption experiments were analyzed using the Langmuir and Freundlich isotherm models. The study found that the lignocellulosic fraction removed Pb(II) ions more efficiently than the crude fraction, with qmax values of 500.0 mg.g−1. Crude fractions exhibited a considerable retention potential for Cd(II), Ni(II), and Cu(II) ions with qmax values of 95.2 mg.g−1, 333.3 mg.g−1 and 200 mg.g−1 respectively. Crude and lignocellulosic fractions extracted from the acorn Q. suber pericarps could be environmentally friendly biosorbents for the removal of metal cations from aqueous solutions.

An electrochemical and theoretical approach towards the efficient microwave synthesis of imidazolium-based ionic liquids for unprecedented mild steel corrosion inhibition in 0.5 M H2SO4 solution

The inhibition potential of newly synthesized imidazolium-based ionic liquids (IL-1 and IL-2) on mild steel corrosion in a 0.5 M H2SO4 solution has been comprehensively investigated using gravimetric analysis, potentiodynamic polarization, and electrochemical impedance spectroscopy across various temperatures. Gravimetric analysis indicated that the adsorption of these inhibitors adhered to the Langmuir adsorption isotherm. Significantly, IL-2, featuring a longer alkyl chain, demonstrated superior inhibition efficiency (92.51 % at 303 K) compared to IL-1 (88.71 % at 303 K). Potentiodynamic polarization studies revealed a mixed-type inhibitory behavior, impacting both anodic and cathodic reactions. Surface morphological analyses via SEM and EDX confirmed the formation of a protective film on the mild steel surfaces, substantiating the corrosion inhibition capabilities of IL-1 and IL-2. The novelty of this research lies in the application of density functional theory (DFT) using the B3LYP method, which elucidated that the alkyl chain length at the N-3 position in imidazolium cation-based ionic liquids significantly enhances their inhibition potential. This mechanistic insight suggests that these ionic liquids effectively obstruct both anodic and cathodic sites, providing robust corrosion protection in a 0.5 M H2SO4 solution.

Synthesis of ZIF-8/chitosan composites for Cu2+ removal from water

ABSTRACT In this work, a kind of novel Chitosan (Cs)-doped zeolite imidazole framework (ZIF-8@Cs) with a larger surface area and a smaller pore size was synthesised via a facial solvothermal approach and applied to remove Cu2+ from mine wastewater. Compared to nondoped ZIF-8, ZIF-8@Cs exhibited a stronger adsorption performance and removal efficiency. The reason was that ZIF-8@Cs doped by the Cs could suppress the aggregation and increase the monodispersity of ZIF-8. Using the high-performance ZIF-8@Cs, as a novel adsorbent, was successfully developed for the efficient removal of Cu2+ from mine wastewater. Various parameters, such as contact time, initial Cu2+ concentration, adsorbent dosage, and pH, were investigated. The results showed that a removal efficiency of 85% was obtained at 4 h contact time for a Cu2+ concentration of 30 mg/L at the optimum pH of 6.0. Equilibrium data were analysed using different isothermal models and kinetic models, analytic results indicated that the capture of Cu2+ by ZIF-8@Cs could favourably comply with the pseudo-first-order kinetic model and Langmuir isotherm model. The single-layer adsorption of Cu2+ on ZIF-8@Cs was dominated by diffusional mass transfer. Additionally, the results of the thermodynamic analysis indicated that the adsorption of Cu2+ by ZIF-8/Cs was a spontaneous, exothermic, and ordered process. Overall, the results reported herein indicated that ZIF-8/Cs with high adsorption efficiency are very attractive and imply a potential practical application for the removal of potentially toxic elements in wastewater.

Enhancing CO2 adsorption performance of cold oxygen plasma-treated almond shell-derived activated carbons through ionic liquid incorporation

To enhance the CO2 adsorption of almond shell-derived activated carbon (AC) samples treated with cold oxygen plasma, the samples were impregnated with cholinium-amino acid ionic liquids ([Cho][AA] ILs) using the vacuum-assisted impregnation method. The physicochemical and textural properties of the resulting composites (ILs@AC) were characterized using various techniques, including Fourier-transform infrared spectroscopy (FTIR), thermogravimetric analysis (TGA), scanning electron microscopy (SEM) coupled with energy-dispersive X-ray (EDX) spectroscopy, and Brunauer-Emmett-Teller (BET) surface area measurement. The CO2 adsorption performance of the samples was evaluated using a quartz crystal microbalance (QCM) over a temperature range of 288.15–308.15 K and gas pressures up to 1 bar. The IL@AC composite materials exhibited notably improved CO2 adsorption capacities compared to pristine AC. The CO2 adsorption isotherms onto the IL@AC composite samples closely conformed to the Langmuir isotherm model, indicating the dominant involvement of strong intermolecular interactions, particularly driven by amine functionalities. Meanwhile, the results revealed that [Cho][His]@AC showed lowered CO2 adsorption capacity compared to [Cho][Pro]@AC and [Cho][Gln]@AC. Among the studied ionic liquids, [Cho][Pro]@AC showed the highest absorption capacity (2.332 mmol·g−1 at 288 K and 1 bar). This was due to the obstruction of internal pores within the AC structure caused by excessive amine incorporation into its porous framework. In the meantime, for a deeper insight into the impregnation process of ILs onto the AC surfaces and their potential interactions with CO2 molecules, we conducted density-functional theory (DFT) calculations using the ωB97XD/6-31 + G(d,p) method. The calculated interaction energies, ranging from − 1.19 to − 1.44 eV, along with calculated quantum chemical descriptors, indicated a notable stabilization of IL species on the AC surfaces, with high affinity toward CO2 molecules.

Electrochemical, thermodynamic and DFT studies of Fomitopsis pinicola as green corrosion inhibitor for carbon steel in sulfuric acid

In this work, the methanolic extract of Fomitopsis pinicola has been evaluated as a green corrosion inhibitor for the dissolution of 1018 carbon steel in 0.5 M sulfuric acid. For this, gravimetric tests and electrochemical methods such as potentiodynamic polarization curves, linear polarization resistance (LPR) and Electrochemical Impedance Spectroscopy (EIS) techniques were used. These tests were aided with Infrared and GC–MS analytical techniques. In addition to this, theoretical calculation with the use of the density functional theory (DFT) technique has been used to correlate the electronic extract properties and its inhibitory capacity. Weight loss results have shown an inhibitor efficiency of 85 % with the addition of 400 ppm. Thermodynamic parameters have shown that Fomitopsis pinicola extract is physically adsorbed onto the steel following a Langmuir adsorption isotherm. Potentiodynamic polarization curves showed that the extract behaves as a mixed type of corrosion inhibitor inducing the formation of a protective film onto the steel surface. In the presence of the Fomitopsis pinicola extract, a more resistive film obtained the highest polarization resistance value when 400 ppm of extract was used. In addition to this, as the concentration of the extract increased the charge transfer resistance and the double electrochemical layer capacitance decreased. GC–MS results indicated that main compounds contained in the Fomitopsis pinicola extract were Dehydrergosterol, Hydrazino-acetic acid ethyl ester, and Phthalic acid, di (2-propylpentyl) ester, whereas theoretical calculations showed that the highest EHOMO and lowest ELUMO values correspond to Dehydrergosterol and the Phthalic acid, which are the responsible for the extract inhibitory properties.

Eco-friendly modified chitosan as corrosion inhibitor for carbon steel in acidic medium: Experimental and in-depth theoretical approaches

The industrial and medical sectors have a great interest in chitosan due to its unique properties, such as abundance, renewability, non-toxicity, antibacterial activity, biodegradability, and polyfunctionality. In this work, two modified chitosan Schiff bases (ChSB-1 and ChSB-2) were made using condensation methods, and their potential as corrosion inhibitor for carbon steel in 1 M HCl was investigated using chemical and electrochemical techniques. The ChSB-1 and ChSB-2 inhibitors exhibited remarkable inhibitory performance, as evidenced by the mass loss data, which showed 89.3 % and 91.5 % efficacy at 1 mM concentration, respectively. Because of the electron-donor substituent of methoxy (–OCH3), ChSB-2's active sites have more delocalized electrons than ChSB-1's. The PDP results showed that both ChSB-1 and ChSB-2 inhibitors have anti-corrosion characteristics because heteroatoms caused a protective layer to develop that functioned as mixed-typed inhibitors. The calculated adsorption-free energy ∆Gadso for ChSB-1 and ChSB-2, respectively, was found −36.1 and − 37.1 kJ mol−1. The ChSB-1 and ChSB-2 inhibitors adsorb on carbon steel in acidic conditions through physisorption and chemisorption interactions, and their adsorption is in line with the Langmuir adsorption model. Inhibited and uninhibited metallic surfaces were subjected to surface morphological assessments using contact angle (CA), the scanning electron microscopy and the energy dispersive X-ray (SEM/EDX) analysis. The DMol3 part of Materials Studio 7.0 software was used to perform the quantum chemical calculations based on DFT to visualize the structural features. Studies from quantum chemistry suggest the possibility of surface interaction between the unoccupied orbitals of the metal surface and the inhibitors ChSB-1, ChSB-2, ChSB-1H+, and ChSB-2H+. The results clearly show that the two inhibitors work well as environmentally friendly carbon steel corrosion inhibitors in acidic medium. This could be advantageous for industrial procedures such as pickling, cleaning, acidizing oil drilling in oil wells, and using citrus to de-sediment boilers.

New Benzimidazole derivatives as efficient organic inhibitors of mild steel corrosion in hydrochloric acid medium: Electrochemical, SEM/EDX, MC, and DFT studies

The corrosion of mild steel (MS), a widely used material in industry, represents a significant global challenge. In order to extend the durability of equipment, the use of corrosion inhibitors proves to be an effective solution, particularly in corrosive environments. In this research, two newly synthesized benzimidazole derivatives, namely 1-(cyclohex-1-en-1-yl)-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,3-dihydro-1H-1,3-benzodiazol-2-one (Benz1) and 1-(cyclohex-1-en-1-yl)-3-[(3-phenyl-4, 5-dihydro-1,2-oxazol-5-yl)methyl]-2,3-dihydro-1H-1,3-benzodiazol-2-one (Benz2), were evaluated as corrosion inhibitors for MS in 1 M hydrochloric acid solution. This study was conducted using both experimental methods and computational approaches. Potentiodynamic polarization diagrams (PDP) indicate that, depending on concentration effects, Benz1 and 2 function as mixed-type inhibitors, with a predominance of cathodic inhibition. The results of electrochemical impedance spectroscopy (EIS) show that the compounds tested offer high inhibition efficiencies of 96.32 % and 98.30 % at 10−⁴ M for Benz1 and 2, respectively. Inhibitor adsorption follows the Langmuir isotherm and involves chemisorption. SEM/EDX analyses confirm the presence of a protective film on the metal. In addition, DFT and Monte Carlo simulations reveal significant adsorption of the compounds on the MS surface, underlining their high potential as effective corrosion inhibitors.

Influence of cephalexin on cadmium adsorption onto microplastic particles in water: Human health risk evaluation

This paper explores the impact of environmental factors on the adsorption of cadmium (Cd) and cephalexin (CEX) onto polyethylene (PE) microplastics. The study focused on Cd adsorption behavior on microplastics (MPs) of various sizes, revealing that particles sized 30–63 μm exhibited the highest adsorption capacity compared to other sizes. Cd sorption was significantly influenced by initial pH and salinity levels. Experimental data closely matched both the Langmuir (R2 > 0.91) and Freundlich (R2 > 0.92) isotherms. Cd adsorption onto PE particles was greater than CEX adsorption, with the maximum Cd uptake capacity measured at 1.8 mg/g. FTIR analysis indicated that Cd and CEX adsorption onto MPs was likely governed by physical interactions, as no new functional groups were detected post-uptake. The desorption rates of Cd and CEX from PE microplastics were evaluated in various liquids, including aqueous solution, tap water, seawater, and synthetic gastric juice. The health risks associated with Cd, in combination with MPs and CEX, for both children and adults were assessed in groundwater and aqueous solutions. This study offers scientific insights and guidelines for examining the environmental behavior, migration, and transformation of microplastics and their related ecological risks in scenarios of combined pollution.

Performance Evaluation of a Romanian Zeolite: A Sustainable Material for Removing Ammonium Ions from Water

Ammonium ion is a chemical species that is found in abundance in natural waters, whether underground or surface, but also in wastewater resulting from agricultural and industrial activities. Even if the removal of the ammonium ion from water has been studied for a very long time, it has been found that its removal is far from being solved. In this study, we evaluated the performance of the ammonium ion adsorption process on two adsorbents, zeolite clinoptilolite, ZR, a sustainable material (manufacturer: Zeolite Development SRL, Rupea, Brasov, Romania), and the other granular activated carbon type, Norit GAC 830 W. Zeolite ZR is found in very large deposits in Romania; it is a natural, cheap material with costs between 50 and 100 EUR/ton, compared to other adsorbents that cost over 500 EUR/ton and which can be regenerated and reused in the technological process of water treatment and purification, but also after exhaustion, as an amendment for the soil. In the first step, this paper presents the mineralogic (XRD) and structural (SEM and EDX) characterization of the ZR and the determination of the pH zero-point charge, pHZPC, for all the adsorbents. Studies were carried out in equilibrium and kinetic conditions. The efficiency of the adsorbent was investigated in different experimental conditions by varying the initial concentration, particle size, temperature, pH, ionic strength, and contact time. The mathematical models and parameters specific to the adsorption isotherms that best describe the experimental results were identified. Langmuir, Freundlich, Temkin, and Dubinin–Radushkevich mathematical models were used for comparison. The Langmuir isotherm proved to be the most appropriate to describe the adsorption of ammonium ions on all types of adsorbents used. The adsorption capacity of ammonium ions from synthetic solutions at 20 °C, pH = 6.09, for the range of initial concentrations 0–50 mg/L for Rupea zeolite is in the range of 10.46 mg/g−12.34 mg/g, and for granular activated carbon GAC W830, it is 16.64 mg/g. It was found that the adsorption capacity of the ammonium ion on both activated carbon and zeolite increases with increasing temperature and pH. Also, it was observed that as the ionic strength increases, the adsorption capacity decreases for all four adsorbents. Kinetic models were also identified that best describe the experimental processes. In this sense, pseudo-first order, pseudo-second order, intra-particle diffusion and the Elovich model were used. The results of the investigation showed that second-order kinetics governs the adsorption process on ZR, and pseudo-first order governs activated carbon.

Efficient adsorption of acid orange 7 from wastewater using novel bio-natural granular bentonite-sawdust-corncob (GBSC): Mixture optimization, adsorption kinetic and regeneration

The removal of dyes from industrial wastewater is one of the most environmental challenges that should be addressed through sustainable technologies. In this study, a novel green and cost-effective granular from bentonite and bio-wastes of sawdust and corncob (GBSC) was prepared for sustainable treatment of acid orange 7 (AO7) dye wastewater. The d-optimal mixture method was employed to determine the optimum combination of the GBSC in terms of dye adsorption and structure stability. Characterizations of the GBSC were investigated using SEM, XRD, FTIR and BET analyses and compared with bentonite powder (BP), modified bentonite powder (MBP), and granular modified bentonite (GMB). According to the results, a mixture of bentonite 60 wt.%, sawdust 20 wt.% and corncob 20 wt.% at 550°C yielded the optimal combination of the GBSC which resulted to the highest adsorption capacity 135.22 mg/g, the lowest mass loss 3.1% and maximum crushing strength 12.275 N. The kinetic and isotherm of the adsorption data were fitted well by the pseudo-second-order model and Langmuir isotherm. Our finding suggested a green circular economy model by utilizing agriculture wastes (sawdust and corncob) to synthesize GBSC for sustainable dye wastewater treatment, which offers a cost-effective adsorbent (0.907 $/g) with high regeneration (4 times reusability with 40.5% removal rate) to keep them in circulation for as long as possible.

Novel Efficient and Eco‐Friendly Biosorbent Derived from Ditax (Detarium senegalense) Fruit Hulls for Removal of Cationic Dyes: Adsorption Modeling and Statistical Optimization

AbstractRemediation of wastewater laden with dyes using optimized and less expensive techniques remains a challenge for environmental protection. In the current research work, alkaline activation approach was employed to derive a biosorbent from ditax fruit hulls (DS‐FHB), and its sorption performance was tested on Methylene blue (MB) dye biosorption with optimizing adsorption parameters. Structural and chemical properties of DS‐FHB including crystallinity, morphology, and surface functionality were analysed using XRD, SEM, FTIR technics, and pHPZC determination. Optimization of adsorption parameters using a centered composite design (CCD) from response surface methodology led to achieving a peak dye removal rate of 98.97 %. The optimal conditions were determined as DS‐FHB mass of 0.23 g, pH 7.12, contact time 39.00 min, and initial MB concentration of 69.35 mg/L. The findings demonstrated a strong alignment with both the Langmuir isotherm and pseudo‐second order kinetic model, suggesting their appropriateness in describing the adsorption process of MB onto DS‐FHB. According to the Langmuir isotherm model, the sorption of MB dye onto DS‐FHB occurred by monolayer formation with a maximum dye sorption capacity of 96.453 mg/g. Based on the structural and physico‐chemical properties of DS‐FHB biosorbent, and its adsoption applicability evaluated in the experimental conditions, detax derived‐biosorbent can be proposed as a successful and effective low‐cost biosorbent for removing cationic dyestuffs from aqueous solutions.

Mechanically durable tri-composite polyamide 6/hematite nanoparticle/tetra-n-butylammonium bromide (PA6/α-Fe2O3/TBAB) nanofiber based membranes for phosphate remediation

Essential properties for a Point of Use (POU) water filter include maintaining high removal capacity and rate, with excellent mechanical properties to withstand pressure drop. Herein, mechanically robust tri-composite polyamide 6/iron oxide nanoparticles/tetra-n-butylammonium bromide (PA6/α-Fe2O3/TBAB) nanofiber composite membranes were electrospun for phosphate (P) remediation, where the diameter and composition were tuned by controlling solution compositions and electrospinning conditions. Tri-composite composition and morphology affect phosphate uptake where the adsorption capacity followed Langmuir isotherm whereas the adsorption kinetics followed pseudo second order behavior. Mechanical properties (i.e., Young’s Modulus (E) and toughness) were significantly influenced by the composition and morphology of the tri-composite, as well. Although additional TBAB and iron oxide decreased toughness, there are optimum composition ranges which resulted in maximum Young’s Modulus. Of the synthesized nanofiber membranes, PA6/α-Fe2O3/TBAB nanofibers with 17% α-Fe2O3 and 2% TBAB showed excellent phosphate uptake capacity [i.e., 8.9 mg/g (52 mg of P/g of α-Fe2O3)] while it is bendable, stretchable, and able to plastically deform without fracturing (i.e., Young’s modulus of 2.06 × 108 Pa and Toughness of 1.35 × 106 J m−3). With concerns over the impact of P on water resources and the long-term availability of limited P resources, this tri-composite membrane is well suited for applications in both wastewater treatment and resource recovery.

Assessment of Warionia saharea Essential Oil as a Green Corrosion Inhibitor for Mild Steel in HCl: Experimental and Computational Studies

The objective of this research work is the study of the inhibitory effect of Warionia saharea essential oil (WSEO) on the corrosion of mild steel (MS) in molar HCl solution, employing both experimental and theoretical methods. This inhibitory effect (IE) has been evaluated by using a combination of weight loss measurements (LW) and various electrochemical methods, such as open circuit potential (OCP), potentiodynamic polarization (PDP) and electrochemical impedance spectroscopy (EIS) experiments. The LW results indicated that IE increased with inhibitor concentration, reaching 83.34% at 3.00 g/L. The PDP analysis suggested that WSEO functions as a mixed inhibitor, while in the EIS results the Rct values increased with inhibitor concentration to reach 165.8 Ω cm2 at 2.00 g/L, suggesting a defensive film formation by WSEO molecules over the metallic surface. The thermodynamic study demonstrated that the WSEO molecules adsorption on the MS surface followed a Langmuir isotherm, involving mixed physical and chemical (physicochemical) adsorption on the MS surface. Theoretical methods, including density functional theory (DFT) and molecular dynamics (MD) simulations, were employed to elucidate the inhibition mechanisms of the three main components of WSEO. The quantum chemical analysis, using density functional theory (DFT) and molecular dynamics (MD) simulations, showed a low ΔEgap value of 6.30 eV and a low adsorption energy (Eads) value on an Fe (110) substrate of −258 Kcal/mol for (E)-Nerolidol, indicating the significant contribution of this molecule to the overall corrosion inhibition effect of WSEO. The scanning electron microscope (SEM) analysis verified the presence of a protective film formed by the inhibitor on the MS surface. This study highlights the potential of WSEO as a sustainable and green corrosion inhibitor in acidic environments.

A flow cytometry method for quantitative measurement and molecular investigation of the adhesion of bacteria to yeast cells

The study of microorganism interactions is important for understanding the organization and functioning of microbial consortia. Additionally, the interaction between yeast and bacteria is of interest in the field of health and nutrition area for the development of probiotics. To investigate these microbial interactions at the cellular and molecular levels, a simple, reliable, and quantitative method is proposed. We demonstrated that flow cytometry enables the measurement of interactions at a single-cell level by detecting and counting yeast cells with bound fluorescent bacteria. Imaging flow cytometry revealed that the number of bacteria attached to yeast followed a Gaussian distribution whose maximum reached 14 bacterial cells using a clinical Escherichia coli strain E22 and the laboratory yeast strain BY4741. We found that the dynamics of adhesion resemble a Langmuir adsorption model, albeit it is a rapid and almost irreversible process. This adhesion is dependent on the mannose-specific type 1 fimbriae, as E. coli mutants lacking these appendages no longer adhere to yeast. However, this type 1 fimbriae-dependent adhesion could involve additional yeast cell wall factors, since the interaction between bacteria and yeast mutants with altered mannan content remained comparable to that of wild-type yeast. In summary, flow cytometry is an appropriate method for studying bacteria-yeast adhesion, as well as for the high-throughput screening of candidate molecules likely to promote or counteract this interaction.

Purification and Kinetics of Chlorogenic Acid from Eucommia ulmoides Oliver Leaves by Macroporous Resins Combined with First-Principles Calculation

Background: A simple and effective method to separate chlorogenic acid from Eucommia ulmoides leaves with macroporous resin was studied in this paper. Methods: In order to optimize the separation process of chlorogenic acid from Eucommia ulmoides leaves, dynamic adsorption and desorption experiments were carried out on a glass column filled with XDA-8 resin. Based on the First-principles calculation, the possible adsorption models were simulated. Results: Among the six macroporous resins, XDA-8 showed good adsorption/desorption capacity and a high adsorption/desorption ratio for chlorogenic acid. After being treated with XDA-8 resin once, the content of chlorogenic acid from the extraction increased by 525%, and the recovery of chlorogenic acid reached 85.36%. Conclusion: At 25°C, the adsorption behavior of chlorogenic acid on XDA-8 resin was consistent with the Langmuir isotherm model and pseudo-second-order kinetic model. Furthermore, by calculating the charge changes of the O atom at each position in the chlorogenic acid molecule and the H atom at the adsorption site in polystyrene molecule with resin skeleton, and combining with the electron cloud density distribution diagram of chlorogenic acid and resin skeleton, the adsorption of chlorogenic acid by XDA-8 resin is mainly due to the charge transfer, which causes the electron cloud to overlap.