Divalent Salts Research Articles

Tailoring thin film composite membranes for clean water production: A study on structural variations and predictive insights using machine learning

This study focuses on the fabrication of three thin film composite membranes by interfacial polymerization on polyacrylonitrile support. The objective is to explore the influence of different monomers on structural and functional features of resultant membranes for treating saline water and removing micropollutants. A new linear aliphatic amine 4A–2E was used as an aqueous monomer for the first time. Trimesoyl chloride, isophthaloyl chloride, and terephthaloyl chloride were used as organic phase crosslinkers. The resulting membranes exhibited distinctive structural features such as varied roughness and hydrophilicity, which correlated with their functional performance. The membrane roughness for 4A–2E-TPC@PAN/PET reached the highest value of Ra = 56 nm among the fabricated membranes. Moreover, permeate flux of 32, 56, and 49 L m−2 h−1 at 25 bar was measured for 4A–2E-TPC@PAN/PET, 4A–2E-IPC@PAN/PET, and 4A–2E-TMC@PAN/PET, respectively. Notably, 4A–2E-TPC@PAN/PET membrane exhibited 98% rejection of MgCl2 among the tested divalent salts. Furthermore, the membrane displayed high rejections of micropollutants, with 85% rejection for Amitriptyline. Upon chlorine exposure, the 4A–2E-TPC@PAN/PET membrane proved more resistant than both 4A–2E-IPC@PAN/PET and 4A–2E-TMC@PAN/PET membranes. Machine learning predictive insight was developed using Matérn Gaussian Process Regression model to simulate flux before and after chlorination of membranes. The results in both training and testing proved reliable predictive insight with 99% accuracy in terms of Nash Sutcliffe Efficiency. Hence, current work highlights the use of a linear amine 4A–2E and TPC crosslinker to fabricate a dense polyamide membrane and the application of ML algorithms to desalination data makes it possible to predict the membrane performance.

Anionic species from multivalent metal salts are differentially retained during aqueous ionic gelation of sodium alginate and could fine-tune the hydrogel properties

The role of anionic counterions of divalent metal salts in alginate gelation and hydrogel properties has been thoroughly investigated. Three anions were selected from the Hofmeister series, namely sulphate, acetate and chloride, paired in all permutations and combinations with divalent metal cations like calcium, zinc and copper. Spectroscopic analysis revealed the presence of anions and their interaction with the respective metal cations in the hydrogel. The data showed that the gelation time and other hydrogel properties were largely controlled by cations. However, subtle yet significant variations in viscoelasticity, water uptake, drug release and cytocompatibility properties were anion dependent in each cationic group. Computational modelling based study showed that metal-anion-alginate configurations were energetically more stable than the metal-alginate models. The in vitro and in silico studies concluded that acetate anions preceded chlorides in the drug release, swelling and cytocompatibility fronts, followed by sulphate anions in each cationic group. Overall, the data confirmed that anions are an integral part of the metal-alginate complex. Furthermore, anions offer a novel option to further fine-tune the properties of alginate hydrogels for myriads of applications. In addition, full exploration of this novel avenue would enhance the usability of alginate polymers in the pharmaceutical, environmental, biomedical and food industries.

Amphiphilic Interlayer Regulated Interfacial Polymerization for Constructing Polyamide Nanofiltration Membranes with High Perm-Selectivity of Mono-/Divalent Salts.

High-quality thin-film composite (TFC) membranes with high selectivity and permeability have great significance owing to their practical applications, specifically for the accurate differentiation of monovalent and divalent ions. However, the trade-off effect between selectivity and permeability is still a big challenge due to the difficult structure adjustment of the selective layer. Herein, polydopamine (PDA) functionalized with a hydrophobic long alkane chain was first explored as a functional amphiphilic interlayer to synthesize high-quality TFC membranes via a confined interfacial polymerization (IP) reaction. The amphiphilic interlayer not only restricted the formation of the polyamide (PA) matrix in the pores of the substrate but also accelerated spatially more homogeneous polymerization and formed a PA active layer with a more uniform pore size distribution. The method may provide an effective principle for the construction of versatile polyamide-based membranes with high perm-selectivity on various supports. The NaCl/Na2SO4 separation factor of the D-8/PA membrane reached as high as 204.07, while the flux increased up to 25.71 L m-2 h-1 bar-1. This progress provides a more feasible way for the construction of high-quality TFC membranes with a devisable and creative amphiphilic interlayer for industrial application.

Impact of engineered water in modulating the wettability of oil–brine–rock system for improved oil recovery

AbstractLow salinity water injection stands as a progressive method for enhanced oil recovery, representing a current focus of extensive research. Understanding wettability alteration in crude oil is hindered by its intricate nature, posing a challenge for researchers. In order to better understand wettability alteration and underlying phenomena in an oil–brine–rock system, a fundamental study was carried out using pure hydrocarbon (aliphatic: n‐heptane; aromatic: toluene) and crude oil on quartz surface against engineered water consist of monovalent (NaCl) and divalent (MgSO4) salts in various compositions (NaCl:MgSO4: 100:0; NaCl:MgSO4: 0:100; NaCl:MgSO4: 75:25; NaCl:MgSO4: 50:50; NaCl:MgSO4: 25:75). The variables under investigation include temperature (25 to 65°C), pure hydrocarbons (toluene, n‐heptane), crude oil (Indian offshore), and brine (B1 to B5) with concentration (0 to 20,000 ppm). The findings show that when brine solution contains solely NaCl salt at a concentration of 2000 ppm, n‐heptane exhibits a minimum contact angle on quartz plate. Contrarily, toluene exhibits a low contact angle with a brine solution that only contains MgSO4 salt at a concentration of 2000 ppm. The intriguing finding is that when monovalent and divalent salts are equal (NaCl:MgSO4: 50:50) in the brine, crude oil exhibits the smallest contact angle on quartz. Additionally, temperature and contact angle are directly related for all oil types. The optimal brine for achieving the minimum contact angle on quartz surface is (B1)2000 for n‐heptane, (B2)2000 for toluene, and (B4)2000 for crude oil for the current study. The study findings indicate that the alteration in wettability due to brine composition and salinity varies among different oil samples, characterized by purely aliphatic, aromatic, and mixed components, and it depends on the type of salt compositions. Higher salts concentration minimally affects n‐heptane but influences toluene and crude oil contact angles.

Preparation and performance of magnetic carbon nanotubes modified PVC substrate composite nanofiltration membranes

Polyamide (PA)/ferroferric oxide/oxidized multi-walled carbon nanotubes (Fe3O4/o-MWCNTs)/polyvinyl chloride (PVC) composite nanofiltration (NF) membranes were prepared by the interfacial polymerization (IP) process with the Fe3O4/o-MWCNTs/PVC porous membrane as the substrate membrane, which was prepared by the magnetic field assisted non-solvent induced phase separation method (NIPS) with the synthesized superparamagnetic Fe3O4/o-MWCNTs nanoparticles (NPs) as the additives of the functional intermediate layer integrated with the substrate. The effects of the magnetic carbon nanotubes modified PVC porous substrate membrane on the surface chargeability, PA layer thickness, mechanical properties, pressure resistance and permeability of the composite NF membranes were investigated, and the comprehensive performance of composite NF membranes was enhanced. The results indicated that the porosity and hydrophilicity of the Fe3O4/o-MWCNTs/PVC porous substrate membrane were improved by the migration of magnetic Fe3O4/o-MWCNTs NPs to the upper edge of the substrate membrane and uniform enrichment under magnetic field induction, which further affected the structure and properties of the PA/Fe3O4/o-MWCNTs/PVC composite NF membrane. The prepared NF membrane presented smaller roughness, thinner PA layer, larger pore size, with excellent mechanical properties and better pressure resistance. Meanwhile, the PA/Fe3O4/o-MWCNTs/PVC composite NF membrane presented excellent divalent salt rejection, with the rejection of MgSO4 and Na2SO4 maintaining more than 95.2% and 93.4%, respectively, while the permeation flux could reach 35.4 L·m−2·h−1. In summary, the modification of the substrate integrated with the functional intermediate layer had certain enlightening significance for the preparation of the NF membrane with excellent comprehensive performance.

Micelles regulated thin film nanocomposite membrane with enhanced nanofiltration performance

The desalination performance of thin film nanocomposite (TFN) membranes is significantly influenced by the nature of nanofillers and the structure of the polyamide (PA) layer. Herein, a micelles regulated interfacial polymerization (MRIP) strategy is reported for the preparation of TFN membranes with enhanced nanofiltration (NF) performance. Specially, stable and ultrafine micelles, synthesized from the poly(ethylene oxide)-b-poly(4-vinyl pyridine)-b-polystyrene (PEO-PVP-PS) triblock copolymers, were utilized as regulators in the aqueous phase during the interfacial polymerization (IP) process. TFN membranes were fabricated with varying concentrations of micelles to improve their properties and performances. The structure of the PA layer was further regulated by modulating the content of trimesoyl chloride (TMC), which significantly enhances the performance of the TFN membrane with micelles. Attributable to the homogeneously dispersed micelles and the modified PA layer, the optimized membrane denoted as TFN-2–0.3 exhibits an improved separation performance of 20.7 L m-2h−1 bar−1 and 99.3 % Na2SO4 rejection, demonstrating nearly twice the permeance and 2.7 % higher rejection than that of the original control membrane, respectively. The mechanism of this MRIP strategy was investigated through the diffusion experiments of piperazine (PIP) and interfacial tension tests. The incorporated micelles effectively lower the interfacial tension, promote the diffusion of PIP and accelerate the IP reaction, resulting in a denser and thinner PA layer. Collectively, these findings demonstrate that TFN membranes with micelles exhibit increased roughness, enhanced hydrophilicity, superior rejection to divalent salts, and better acid-base resistance, highlighting their potential applications in the design of TFN membranes.

Saturated Micellar Networks: Phase Separation and Nanoemulsification Capacity

Different oils can be homogeneously dispersed in the network junctions of the separated bicontinuous micellar phases. Upon dilution, these dispersions spontaneously form nanoemulsions. The possibility of a micellar sponge phase formation in the case of mixtures with three anionic and two zwitterionic surfactants in the presence of divalent and monovalent salts is studied. The best results are obtained using sodium lauryl ether sulfate with 1 ethylene oxide group (SLES-1EO) and both cocamidopropyl betaine (CAPB) or N,N-dimethyldodecylamine N-oxide (DDAO) in the presence of an appropriate small amount of MgCl2 and CaCl2. Bicontinuous micellar phases can be produced also in high-salinity NaCl solutions. The bulk properties of these phases are independent of the concentration of the initial solutions from which they are separated, and their Newtonian viscosities are in the range from 0.3 Pa·s to 0.8 Pa·s. Both 8 wt% CAPB- and DDAO-containing sponge phases engulf up to 10 wt% limonene and spontaneously form nanoemulsion upon dilution with droplet sizes of 110–120 nm. Vitamin E can be homogeneously dispersed only in CAPB-containing saturated micellar network, and upon dilution, these dispersions spontaneously form nanoemulsions with smaller droplet sizes of 66 nm for both 8 diastereomers and 2 diastereomers mixtures of vitamin E.

Effects of different salt ions on the structure and rheological behavior of sulfated cellulose nanocrystal hydrogel

Cellulose nanocrystal (CNC) hydrogels are increasingly used in various applications. Here, CNC hydrogels were formed by adding four salt ions (NaCl, KCl, MgCl2, and CaCl2) to sulfated CNC suspensions. NaCl and KCl are monovalent salt ions and MgCl2 and CaCl2 are divalent salt ions; each pair has similar cation charges but different cation radii. This study compared the effects of four salt ions on the structure and rheological behavior of CNC hydrogels. At the same ion concentration, compared with NaCl and KCl, the addition of MgCl2 and CaCl2 significantly reduced the distance between the CNC particles, forming pronounced aggregates and denser network structures. Furthermore, the G′ and G″ of the CNC hydrogels with salt ions followed the order NaCl < KCl < MgCl2 < CaCl2 in the small-amplitude oscillatory shear (SAOS) test, and more viscoelastic hydrogels exhibited relatively lower deformability in the creep-recovery test. Under large-amplitude oscillatory shear (LAOS) conditions, the CNC hydrogels with salt ions exhibited LAOS type III behavior, and the change in yield stress followed the same order as the SAOS results. Among them, CNC hydrogel with CaCl2 exhibited stronger nonlinear response and enhanced strain-stiffening behavior (higher I3/I1 and e3/e1) to resist deformation before 20% strain, as well as an enhanced softening effect (higher |v3/v1|) as the structure was destroyed and rearranged at strains ranging from 20% to 100%. Such CNC hydrogels with different salt ions, which can regulate structural and rheological properties, provide basis for designing hydrogels and meet potential requirements in food and biomedicine fields.

Acetic acid as a protic solvent for reducing sulphuric acid concentrations in the production of cellulose nanocrystals alongside transition metal co-catalysts

Cellulose nanocrystals (CNC) conventionally involve highly concentrated sulphuric acid, which typically resulted in the formation of undesirable by-products. Although less corrosive mineral acids have been explored as alternatives, high concentrations are still required. In this study, CNC was successfully isolated from Leucaena leucocephala wood using mild sulphuric acid with acetic acid as protic solvent, and it was further studied with the addition of Lewis acids in the form of multivalent transition metal salts as co-catalyst. Selected divalent and trivalent transition metal salts including (Cr(NO3)3, Fe(NO3)3, Co(NO3)2, and Ni(NO3)2) were investigated. The morphology, chemical structure, particle size, and physicochemical properties of the CNCs were determined. Controlled depolymerization of cellulose was observed using transmission electron microscopy (TEM). Rod-like morphology for all CNCs was obtained during the hydrolysis process with the smallest CNC particles found at an average length of 278.1 ± 35.1 nm and a diameter of 13.4 ± 3.0 nm. The results showed that higher valence state metal ions resulted in better cellulose hydrolysis efficiency. In addition, the use of transition metal salt as a co-catalyst improved production efficiency and minimised carbonization of CNC while maintaining desired crystallinity and thermal properties.

Clean-In-Place (CIP) wastewater management using nanofiltration (NF)-forward osmosis (FO)-direct contact membrane distillation (DCMD): Effects of draw salt

A substantial amount of water is being used during Clean-in-Place (CIP) operation, and is transformed into wastewater that can cause eutrophication to the nearby ecosystem. The present study proposed the Nanofiltration (NF) – Forward Osmosis (FO) – Direct Contact Membrane Distillation (DCMD) to recover the cleaning agents and reclaim freshwater from the model CIP wastewater. NF steps were suggested as prefiltration steps to remove organic compounds from the CIP wastewater. NF steps reduced the lactose and protein contents by 100 % and 95.6 %, respectively. The permeates from NF steps were further managed by the integrated FO-DCMD system. Several draw salts such as NaCl, KCl, MgCl2, and CaCl2 were compared to investigate the influence on FO and DCMD performance. It was found that monovalent salts (NaCl and KCl) outperformed the divalent salts (MgCl2 and CaCl2) in terms of water flux for both FO and DCMD. This can be attributed to the lower viscosity and higher mass transfer coefficient. In addition, the replenishment costs of each salt were evaluated since salts loss occurred during FO and DCMD operation. The cost evaluation revealed that NaCl is most the cheapest salts per reclaimed water. All of this observation indicates that NaCl is preferred in terms of water flux and replenishment cost. The NF permeate kept concentrated using the integrated FO-DCMD or single FO with 2 M of NaCl. Compared to a single FO that showed a consistent decline in draw solution concentration, FO-DCMD could maintain the concentration of the draw solution. Despite the constant concentration, flux decline of FO was observed due to fouling formation caused by the high-temperature operation. However, the FO-DCMD could accomplish the recovery of pure water. Finally, the cleaning agents recovered by the NF-FO-DCMD showed the cleaning efficacy comparable to the fresh NaOH. These results suggest the potential of the proposed system to manage the CIP wastewater.

Salinity and pH effects on water-oil-calcite interfaces by using molecular dynamics.

Smart water injection is a technology that allows changing the wettability of the oil rock by injecting water at different salinities, in a cheap and environmentally friendly way compared to other traditional methods. In this study, the individual effect of some typical salts on the wettability of the (104) surface of calcite toward non-polar and polar crude oil models was explored by molecular dynamics as a function of the salinity and pH. The results obtained show that the electrical double layer plays a principal role in the detachment of crude oil models. The divalent ion salts, i.e., CaCl2, CaSO4, MgCl2, and MgSO4, do not form the electrical double layer on calcite, but salts of NaCl and Na2SO4 form it. Moreover, the surface affinity of calcite to the non-polar crude oil is not affected by the salinity. However, the affinity of the calcite surface toward polar crude is affected by salinity and pH conditions. This research provides new insights into the action mechanisms that could help optimize its uses in enhanced oil recovery.

Performance of ionic liquid functionalized metal organic frameworks in the adsorption process of phenol derivatives.

The growth of industrial activities has produced a significant increase in the release of toxic organic pollutants (OPs) to the environment from industrial wastewater. On this premise, this study reports the use of metal organic frameworks (MOFs) impregnated with various ionic liquids (ILs) in the adsorption of phenol derivatives, i.e., 2,6-dimethylphenol and 4,4'-dihydroxybiphenyl. MOFs were prepared starting from 1-hydroxyethylidene-1,1-diphosphonic acid (HEDP) with divalent (Co, Ni, Cu) and trivalent (Ce) metal salts in mild hydrothermal conditions using water as a green solvent. Imidazolium base ionic liquids, namely 1-butyl-3-methylimidazolium trifluoromethanesulfonate, 1-butyl-3-methylimidazolium nitrate, 1-butyl-3-methylimidazolium chloride, and 1-hexyl-3-methyl-imidazolium chloride, were used to modify MOFs, leading to composite materials (IL@MOF), which show the structural characteristics of MOFs, and complement the advantages of ILs. SEM, EDX images, and TG data indicate that the IL is just attached on the surface of the adsorbent material, with no changes in crystal size or morphology, but with slightly altered thermal stabilities of IL@MOF composites compared to the original ILs and MOFs, pointing to some interionic interaction between IL and MOF. This research consists of equilibrium experiments, studying the effect of the initial concentration of OPs on the adsorption efficiency of the as-prepared MOFs and IL@MOF, in order to determine the influence of the nature of the adsorbent on its developed adsorption capacity and to investigate the performance of both ILs and MOFs. To determine the maximum adsorption capacity, several empirical isotherms were used: Langmuir, Freundlich, Redlich-Peterson, and Dubinin-Radushkevich. The characteristic parameters for each isotherm and the correlation coefficient (R2) were identified. The IL modification of MOFs increased the adsorption capacity of IL@MOF for the removal of phenol derivatives from aqueous solution. The adsorption capacity function of the MOF structure follows the trend CeHEDP > CoHEDP > NiHEDP > CuHEDP. The best performance was achieved by adsorbent materials based on Ce.

Low temperature regulated reverse interfacial polymerization for fabricating thin film composite membranes based on nanofibrous substrates

In this study, a novel thin film nanofibrous composite (TFNC) nanofiltration (NF) membranes comprised of polyacrylonitrile (PAN) nanofibrous supporting layer and polyamide (PA) compact separating layer was constructed by low-temperature-controlled reverse interfacial polymerization (LTIP-R) at − 5 °C. The strategy for lowering the temperature of organic phase solution played a crucial role in forming a dense and thin PA layer on the PAN nanofibrous substrate with submicron pores. The results revealed that the reduced evaporation rate of organic phase at low temperature was contributed to maintaining a complete and uniform interface for the following reverse IP process, effectively overcoming shortcomings of surface incompleteness and easy infiltration of PA barrier layer. Owing to the reduced thickness and the enhanced wholeness of the PA separating layer via LTIP-R, the optimized TFNC membranes exhibited NF performance with great rejection of divalent salt ions (98.2%) and an improved permeation (13.3 L‧m−2‧h−1‧bar−1). This work would provide an efficient and facile method to fabricate high performance NF membranes for practical applications.

Advances in Nanohybrid Membranes for Dye Reduction: A Comprehensive Review.

Separating valuable materials such as dyes from wastewater using membranes and returning them to the production line is a desirable environmental and economical procedure. However, sometimes, besides filtration, adsorption, and separation processes, pollutant destruction also can be suitable using photocatalytic membranes. The art of producing nanohybrid materials in contrast with nanocomposites encompasses nanomaterial synthesis as a new product with different properties from raw materials for nanohybrids versus the composition of nanomaterials for nanocomposites. According to the findings of this research, confirming proper synthesis of nanohybrid is one challenge that can be overcome by different analyses, other researchers' reports, and the theoretical assessment of physical or chemical reactions. The application of organic-inorganic nanomaterials and frameworks is another challenge that is discussed in the present work. According to the findings, Nanohybrid Membranes (NHMs) can achieve 100% decolorization, but cannot eliminate salts and dyes, although the removal efficiency is notable for some salts, especially divalent salts. Hydrophilicity, antifouling properties, flux, pressure, costs, usage frequency, and mechanical, chemical, and thermal stabilities of NHMs should be considered.

DNA Probes for Cas12a-Based Assay with Fluorescence Anisotropy Enhanced Due to Anchors and Salts.

CRISPR/Cas12a is a potent biosensing tool known for its high specificity in DNA analysis. Cas12a recognizes the target DNA and acquires nuclease activity toward single-stranded DNA (ssDNA) probes. We present a straightforward and versatile approach to transforming common Cas12a-cleavable DNA probes into enhancing tools for fluorescence anisotropy (FA) measurements. Our study involved investigating 13 ssDNA probes with linear and hairpin structures, each featuring fluorescein at one end and a rotation-slowing tool (anchor) at the other. All anchors induced FA changes compared to fluorescein, ranging from 24 to 110 mr. Significant FA increases (up to 180 mr) were obtained by adding divalent metal salts (Mg2+, Ca2+, Ba2+), which influenced the rigidity and compactness of the DNA probes. The specific Cas12a-based recognition of double-stranded DNA (dsDNA) fragments of the bacterial phytopathogen Erwinia amylovora allowed us to determine the optimal set (probe structure, anchor, concentration of divalent ion) for FA-based detection. The best sensitivity was obtained using a hairpin structure with dC10 in the loop and streptavidin located near the fluorescein at the stem in the presence of 100 mM Mg2+. The detection limit of the dsDNA target was equal to 0.8 pM, which was eight times more sensitive compared to the common fluorescence-based method. The enhancing set ensured detection of single cells of E. amylovora per reaction in an analysis based on CRISPR/Cas12a with recombinase polymerase amplification. Our approach is universal and easy to implement. Combining FA with Cas12a offers enhanced sensitivity and signal reliability and could be applied to different DNA and RNA analytes.

Molecular dynamics simulation of hydrogen diffusion into brine: Implications for underground hydrogen storage

Underground hydrogen storage has been the subject of extensive research recently. Hydrogen diffusion coefficient into brine critically affects hydrogen loss. However, the available data pertain to hydrogen diffusivity in pure water or NaCl solutions, with rare interpretations of temperature and salinity effects. In this paper, molecular dynamics simulations at realistic conditions were conducted to calculate these coefficients in various brines, particularly those containing divalent salts. The results indicate lower diffusivities at higher salinities and lower temperatures, the value being 7.29 × 10−9 m2/s at 323 K, increasing to 10.2 × 10−9 m2/s at 353 K for 1 molal NaCl solution. The diffusion coefficient decreases up to 38 % as the salinity increases from 1 to 5 molal. Besides, hydrogen diffusivity in MgCl2 solution is up to 60 % smaller than in NaCl solutions at the same molality. Radial distribution functions and hydrogen bond analyses confirm the results. This research provides new data for estimating hydrogen loss in aquifers or water-saturated caprocks.

Water-CO2 wettability on sandstone surface with asphaltene adsorption: Molecular dynamics simulation

The reactions between CO2 slugs and crude oil induce a substantial amount of asphaltene precipitation and adsorption on the rock surface during the CO2 alternative water flooding process. When the subsequent water slug passes through the core pores after asphaltene adsorption, it will displace the previous CO2 slug. The wettability of water and CO2 on the asphaltene-adsorbed rock surface will directly determine the magnitude and direction of the capillary force of the two media, which in turn affects their flow resistance and flow pattern analysis. In this paper, the systems of CO2/water/sandstone and CO2/water/asphaltene adsorption sandstone were established by molecular dynamics simulation technology. The effects of asphaltene adsorption, thickness of the asphaltene adsorption layer, CO2 density, mass fraction and type of salt in water on the wettability of water on sandstone surfaces were studied. The results reveal that asphaltene adsorption significantly reduces the wettability of water on the original powerful water-wetting sandstone surface, making it easier to see how CO2 density affects the wettability of water on the asphaltene-adsorbed sandstone surface. The increased CO2 density will continue to lower the wettability of water on the asphaltene-adsorbed sandstone surface, even causing it to become wet with CO2. The adsorption thickness of asphaltene does not affect the wettability of water and CO2 on the asphaltene-adsorbed sandstone surface, and just a layer of 5A-thick asphaltene adsorption can significantly reduce the wettability of water on sandstone surfaces. Furthermore, a rise in salinity in water has a detrimental impact on the wettability of water on the asphaltene-adsorbed sandstone surface, with divalent salts having a stronger negative effect than monovalent salts.

Исследование возможности переноса насыщения в новом комплексе никеля(II) с 2,6-&lt;i&gt;бис&lt;/i&gt;(пиразол-3-ил)пиридином

By reacting the N,N'-disubstituted 2,6-bis(pyrazol-3-yl)pyridine ligand (L) with a divalent nickel salt, a new nickel(II) complex [Ni(L)(H2O)(THF)Cl]BPh4 was obtained (I), which was isolated in individual form and characterized by elemental analysis, mass spectrometry, NMR spectroscopy and X-ray diffraction (CCDC No. 2221412). According to NMR spectroscopy data in combination with the results of quantum chemical calculations, complex I in solution does not exhibit a saturation transfer effect.

Ceramic thin-film composite membranes with tunable subnanometer pores for molecular sieving

Ceramic membranes are a promising alternative to polymeric membranes for selective separations, given their ability to operate under harsh chemical conditions. However, current fabrication technologies fail to construct ceramic membranes suitable for selective molecular separations. Herein, we demonstrate a molecular-level design of ceramic thin-film composite membranes with tunable subnanometer pores for precise molecular sieving. Through burning off the distributed carbonaceous species of varied dimensions within hybrid aluminum oxide films, we created membranes with tunable molecular sieving. Specifically, the membranes created with methanol showed exceptional selectivity toward monovalent and divalent salts. We attribute this observed selectivity to the dehydration of the large divalent ions within the subnanometer pores. As a comparison, smaller monovalent ions can rapidly permeate with an intact hydration shell. Lastly, the flux of neutral solutes through each fabricated aluminum oxide membrane was measured for the demonstration of tunable separation capability. Overall, our work provides the scientific basis for the design of ceramic membranes with subnanometer pores for molecular sieving using atomic layer deposition.

Ion Partition in Polyelectrolyte Gels and Nanogels.

Polyelectrolyte gels provide a load-bearing structural framework for many macroscopic biological tissues, along with the organelles within the cells composing tissues and the extracellular matrices linking the cells at a larger length scale than the cells. In addition, they also provide a medium for the selective transportation and sequestration of ions and molecules necessary for life. Motivated by these diverse problems, we focus on modeling ion partitioning in polyelectrolyte gels immersed in a solution with a single type of ionic valence, i.e., monovalent or divalent salts. Specifically, we investigate the distribution of ions inside the gel structure and compare it with the bulk, i.e., away from the gel structure. In this first exploratory study, we neglect solvation effects in our gel by modeling the gels without an explicit solvent description, with the understanding that such an approach may be inadequate for describing ion partitioning in real polyelectrolyte gels. We see that this type of model is nonetheless a natural reference point for considering gels with solvation. Based on our idealized polymer network model without explicit solvent, we find that the ion partition coefficients scale with the salt concentration, and the ion partition coefficient for divalent ions is higher than for monovalent ions over a wide range of Bjerrum length (lB) values. For gels having both monovalent and divalent salts, we find that divalent ions exhibit higher ion partition coefficients than monovalent salt for low divalent salt concentrations and low lB. However, we also find evidence that the neglect of an explicit solvent, and thus solvation, provides an inadequate description when compared to experimental observations. Thus, in future work, we must consider both ion and polymer solvation to obtain a more realistic description of ion partitioning in polyelectrolyte gels.