Solutions Of Complexes Research Articles

Инновационный инспекционно-досмотровый комплекс таможенных пунктов пропуска

The article considers promising technical solutions of inspection and inspection complexes for the inspection of large-sized objects during their customs control at checkpoints. A positive aspect is a significant improvement in the quality of X-ray images of objects, which is especially important when they are automatically analyzed using artificial intelligence.

Study of Complexation Patterns in the System Ni2+, MoO42–, P2O74–, Cit3–for the Development of Poly-Ligand Electrolytes (Study of complexation patterns)

The complexation behavior in systems containing Ni2+, MoO42−, P2O74−, Cit3− - ions have been thoroughly investigated. The study determined the composition and instability constants of both mono- and biligand complex compounds at a constant ionic strength of the solution (Ic=1). By analyzing the concentration ratios of the complexing agent and ligands, the composition of mono- and polyligand complexes was elucidated. The complexation study utilized the potentiometric method, which is based on the functional dependence of the potential of the indicator electrode on the concentration of the complexing agent ions. The results enabled the calculation of the ionic composition of aqueous solutions of nickel complexes with citrate and diphosphate ions, depending on their concentrations. A proposed scheme for the formation of heteronuclear nickel-molybdenum complexes takes into account the sequence of component introduction into the electrolyte to form complexes of a specific composition. These findings were applied to develop electrolyte compositions for coating with alloys based on iron subgroup metals with molybdenum. These alloys exhibit several valuable properties, including corrosion resistance, electrocatalytic activity in hydrogen production, and enhanced operational characteristics.

Integrating datasets from herbarium specimens and images to treat a Neotropical myrtle species complex.

Herbaria are the most important source of information for plant taxonomic work. Resources and technologies available today, such as digitised collections and herbarium DNA sequencing, can help accelerate taxonomic decisions in challenging plant groups. Here we employ an integrative methodology relying exclusively on herbarium specimens to investigate species boundaries in the Neotropical Myrcia neoobscura complex (Myrtaceae). We collected morphometric data from high-resolution images of herbarium sheets and analysed it using hierarchical clustering. We posteriorly tested the obtained morpho-groups with phylogenomics using the Angiosperms353 probe kit. We also gathered phenological and geographic information from specimen labels and built phenological histograms and ecological niche models to investigate ecological differences amongst taxa. Current circumscriptions of Myrcia arenaria, Myrcia neoglabra and Myrcia neoregeliana are confirmed in this study. Conversely, the four pieces of evidence together support Calyptranthes langsdorffii var. grandiflora, Marlierea regeliana var. parviflora and Marlierea warmingiana as separate from Myrcia marliereana, Myrcia neoriedeliana and Myrcia neoobscura, respectively, contrary to arrangements proposed by previous authors. Integrated analyses also support separation between Myrcia excoriata and two similar, undescribed taxa. Our data reveal the need for major changes in the systematics of the group, with recognition of 12 species. The successful delivery of our study aims was possible due to obtaining robust, high-quality data from museum specimens. We emphasise the importance of maintaining botanical collections physically and digitally available for taxonomic work and advocate their use to accelerate holistic taxonomic solutions of tropical species complexes. This is urgent, given the paucity of funds for fieldwork and unprecedented rates of habitat loss in the tropics.

Temperature Changes in Luminescence of Mixed Complexes of Terbium and Samarium with Organic Ligands Based on 2,2-bipyridyldicarboxamides

Solutions in acetonitrile of three mixed complexes of rare earth elements (terbium and samarium) with organic ligands with various pyridine substituents were studied in this work. The ratios of ligands and metals in the resulting complexes were determined, and the stability constants of samarium complexes were calculated using the spectrophotometric titration method. Measurements of absorption, emission and excitation spectra of luminescence, luminescence kinetics of solutions of mixed complexes of rare earth elements with an excess of metal relative to the ligand were carried out at various temperatures in the range 298–328 K. An increase of luminescence intensity of a samarium ion in complex upon heating has been discovered for the first time. The dependences of the luminescence quantum yield and lifetime of mixed complexes on temperature were obtained. A thermometric parameter — the ratio of the integral luminescence intensities of samarium and terbium ions — was proposed, and the temperature sensitivity coefficient of this parameter was determined for different complexes.

Synthesis, characterization and computational studies of the triangle shape complex of silver nitrate with 2-amino-1,3,4-thiadiazole

A new mononuclear salt-like silver(I) complex [AgL3]NO3 (Complex 1), which was readily fabricated from 2-amino-1,3,4-thiadiazole (L), is reported. Complex 1 was analyzed by elemental analysis, FT-IR and UV–vis spectroscopy, and single crystal X-ray diffraction. Intermolecular contacts for the cation [AgL3]+ in the crystal structure of Complex 1 were examined using the Hirshfeld surface analysis. The DFT-based calculations were additionally applied to reveal electronic features of Complex 1. The molecular structure of Complex 1 exhibits a mononuclear planar cation [AgL3]+ of the triangle shape with three ligands L being monocoordinated through thiadiazole the nitrogen atom, located at the third position. Two cations [AgL3]+, which, in turn, are stabilized by three NH⋯N hydrogen bonds, are stacked through a rich variety of noncovalent interactions formed by the thiadiazole π-system, yielding a supramolecular dimer {[AgL3]2}2+. These dimers are linked through Ag⋯Ag interactions with the formation of a 1D supramolecular cationic pillar {[AgL3]n}n+. A solution of Complex 1 in EtOH absorbs in the UV region due to intraligand transitions within L. Theoretical calculations revealed a strong electrophilic nature of the optimized structure of Complex 1.

A Novel Pelican Bird Optimization Algorithm based Optimal Allocation of Combined DGs and EVCSs for Improving Voltage Stability of RDS

Objectives: The main objective of the proposed investigation is to enhance the voltage stability of Radial Distribution System (RDS). It is achieved by proper allocation between combined Electric Vehicle Charging Stations (EVCSs) and Distributed Generators (DGs) in RDS. Here, three objective functions such as Real Power loss, Average Voltage Devotion Index (AVDI) and Voltage Stability Index (VSI) are considered. Methods: The multi-objective optimization problem is implemented using a novel and an effective Pelican Optimization Algorithm (POA) to attain the best compromised solutions. POA is a nature inspired parameter less optimization tool and it is well suited for solution of complex, non-linear voltage stability problem. It determines the most excellent site and size of the EVCSs and DG units. The control parameter of POA considered are population size as 40, the number of variables as 8 and the maximum number of iterations as 100. MATLAB 14.0 platform is utilized for the projected problem. Findings: The bench mark test system of IEEE-33 node system is considered to authenticate the presentation of planned POA methodology. The outcomes such as minimized power loss and AVDI, improved voltage at each bus and VSI are presented. The percentage of loss reduction 39.30% is enhanced, when compared with the base case approach and 5.42 % more improved than the other existing methods like TLBO and HHO approaches. Similarly, the VSI 24.96 % is improved, when compared with the base case method and 1.58 % better than the other obtainable methods. Novelty: The POA is a newly urbanized and well-designed optimization algorithm. It efficiently reaches the global optimal solutions with less time duration. The comparative study with the existing algorithm of TLBO and HHO is considered to prove the performance of Projected POA approach. Keywords: Radial distribution system, Distributed Generators, Electric Vehicles, Charging Stations, Voltage stability, Network loss reduction, Pelican Optimization Algorithm

Synthesis and Catalytic Activity of Novel Complexes Based on Cyano-Substituted Phthalocyanines as Promising Drug Conversion Agents

This paper presents the results of obtaining new cobalt and zinc complexes based on dicyanophenoxy-substituted carboxypthalocyanine. The original method of synthesis and isolation of the compound is shown; its spectroscopic and photophysical characteristics are studied. Studies show the absence of aggregation processes in organic media for solutions of complexes in working concentration ranges. This shows the possibility of the practical application of structures as catalysts. The high catalytic activity of cobalt complexes with dicyanophenoxy-substituted carboxyphthalocyanine ligand in the conversion reaction of sodium diethyldithiocarbamate to disulfiram, which is an active component of drugs for the treatment of alcohol dependence, is determined.

Synthesis, Structural Elucidation, Density Functional Theory Calculations, In Vitro Antimicrobial, Anti‐Inflammatory and Anticancer Activities of Novel Zn (II)‐Group Fourteen Heterobimetallic Complexes Derived From Schiff Base Ligand

ABSTRACTIn the present work, new heterobimetallic complexes with the general formula [Zn(C16H32N8)M2(R)4Cl2], where M = Sn (IV) and Si (IV) and R = ‐CH3 and ‐C6H5, were synthesized by reacting the methanolic solution of the monometallic complex [Zn(C16H36N8)Cl2] with group 14 organometallic dichloride [(CH3)2SnCl2/(C6H5)2SnCl2/(CH3)2SiCl2/(C6H5)2SiCl2]. The structures of the synthesized complexes were determined using several spectrometric techniques, including FT‐IR, 1H NMR, 13C NMR, 119Sn NMR, 29Si NMR, ESI‐MS, PXRD, and molar conductivity measurements. Density functional theory (DFT) calculations were carried out to investigate the quantum chemical characteristics of the newly synthesized Zn (II) complexes. The antimicrobial potential of the monometallic and heterobimetallic complexes was evaluated against two Gram‐positive bacteria (Bacillus subtilis and Bacillus cereus), two Gram‐negative bacteria (Xanthomonas campestris and Pseudomonas aeruginosa), and two fungal strains (Aspergillus flavus and Fusarium oxysporum) by the agar well diffusion method, with heterobimetallic complex [Zn(C16H32N8)Sn2(C6H5)4Cl2] as the most potent complex against microbes. The complex [Zn(C16H32N8)Sn2(C6H5)4Cl2] exhibited significant potential in inhibiting inflammation, demonstrating an IC50 value of 9.75 μg/mL, which closely rivals that of the standard drug sodium diclofenac (IC50 = 4.59 μg/mL). Furthermore, all the synthesized compounds were assessed for their anticancer potential against three cancer cell lines (HCT‐116, MCF‐7, and HeLa) by the MTT assay. The results indicated that the complex [Zn(C16H32N8)Sn2(C6H5)4Cl2] exhibited the most pronounced cytotoxic effects, with values of 4.25 ± 0.15 μM, 4.90 ± 0.18 μM, and 5.20 ± 0.24 μM observed for HCT‐116, MCF‐7, and HeLa cancer cell lines, respectively.

Lightweight single-phase Al-based complex concentrated alloy with high specific strength

Developing light yet strong aluminum (Al)-based alloys has been attracting unremitting efforts due to the soaring demand for energy-efficient structural materials. However, this endeavor is impeded by the limited solubility of other lighter components in Al. Here, we propose to surmount this challenge by converting multiple brittle phases into a ductile solid solution in Al-based complex concentrated alloys (CCA) by applying high pressure and temperature. We successfully develop a face-centered cubic single-phase Al-based CCA, Al55Mg35Li5Zn5, with a low density of 2.40 g/cm3 and a high specific yield strength of 344×103 N·m/kg (typically ~ 200×103 N·m/kg in conventional Al-based alloys). Our analysis reveals that formation of the single-phase CCA can be attributed to the decreased difference in atomic size and electronegativity between the solute elements and Al under high pressure, as well as the synergistic high entropy effect caused by high temperature and high pressure. The increase in strength originates mainly from high solid solution and nanoscale chemical fluctuations. Our findings could offer a viable route to explore lightweight single-phase CCAs in a vast composition-temperature-pressure space with enhanced mechanical properties.

Treatment of Plantar Warts with a Nitric-Zinc Complex Solution: A Review of 72 Cases.

There are multiple conservative treatment options for plantar warts, but none have proven to be universally effective. Nitric acid is often used empirically by podiatrists in the treatment of plantar warts. A novel medical device or topical solution of nitric-zinc complex solution (NZCS) could potentially offer an effective and safe alternative for the targeted treatment of plantar warts. To observe the rate of complete healing of NZCS in a series of plantar wart cases and to establish the minimum number of product applications and time needed for healing. This will help standardize and protocolize its use. A descriptive study was conducted involving 72 patients who exhibited symptoms of plantar warts. These patients underwent chemical treatment using a nitric-zinc complex. The cure rate with NZCS was 59.2%. The average number of NZCS applications was 5.9 ± 3.0 and the mean duration of treatment was 9.4 ± 7.1 weeks. A recurrence rate of 6.7% was observed. The topical solution of the nitric-zinc complex is an effective treatment for plantar warts, which can be considered a first-line treatment option in the general population.

Isolation of chitosan-melanin complex from black soldier fly adults and obtaining nanofibrous materials based on it

The article presents the results of studying the viscosity of chitosan-melanin complex solutions from the larvae of the insect Hermetia illucens and the process of gelation in these solutions in the presence of crosslinking reagents. Chemically cross-linked nanofibers were obtained from solutions of the chitosan-melanin complex in dilute solutions of acetic acid by the method of spinneretless electrospinning. The presence of 14% melanin made it possible to reduce the concentration of acetic acid in the spinning composition.

Ab initio investigation of the geometrical behavior in solution and electronic structure of the anion complexes [bis(1,3-dithiole-2-thione-4,5-dithiolate)M], for M = Bi(III), Sb(III), and Zn(II).

1,3-Dithiole-2-thione-4,5-dithiolate (dmit) ligands are known for their conductive and optical properties. Dmit compounds have been assessed for use in sensor devices, information storage, spintronics, and optical material applications. Associations with various metallic centers endow dmit complexes with magnetic, optical, conductive, and antioxidant properties. Optical doping can facilitate the fabrication of magnetic conductor materials from ground-state nonmagnetic cations. While most studied complexes involve transition-metal centers due to their diverse chemistry, compounds with representative elements are less explored in the literature. This study investigated the structural and electronic properties of bisdmit complexes with representative Bi(III), Sb(III), and Zn(II) cations. AIMD calculations revealed two new geometries for Bi(III) and Zn(II) complexes, diverging from the isolated geometry typically used in quantum chemical calculations. The coordination of acetonitrile molecules to the cationic centers of the complexes resulted in unstable structures, while the dimerization of the complexes was stable. SA-CASSCF/NEVPT2 calculations were applied to the structures of the isolated complexes and stable dimers, confirming the multireference character of the electronic structure of the three systems and the multiconfigurational character of the Bi(III) complex. The electronic spectra simulated by the STEOM-DLPNO-CCSD calculations accurately reproduced the experimental UV‒Vis spectra indicating the participation of the isolated Bi(III) dmit complex and its dimeric form in solution. AIMD calculations of the dmit salts were conducted using the GFN2-xTB method with 60 explicit acetonitrile molecules as the solvent at 300K for a total simulation time of 50.0ps, with printing intervals of 0.5fs. The final geometries were optimized employing the PBEh-3c compound method, incorporating implicit conductor-like polarizable continuum model (CPCM) solvation for acetonitrile. Local energy decomposition (LED) analysis at the DLPNO-CCSD(T)/Def2-TZVP level of theory was utilized to investigate the stability of the complex geometries identified by AIMD. The electronic structures of the complexes were assessed using the SA-CASSCF/NEVPT2/Def2-TZVP method to confirm the multiconfigurational and multireference nature of their electronic structures. Electronic spectra were analyzed using the STEOM-DLPNO-CCSD/Def2-TZVP method, with CPCM used to simulate an acetonitrile medium.

Выставочное пространство российских музеев как объект культуры

The article examines the exhibition space of Russian museums of the Soviet and post-Soviet periods as an object of culture. Emphasis is placed on its importance in shaping and reflecting social values, and the evolution of exhibition spaces, design elements, and the role they play in presenting, interpreting, and preserving cultural heritage are examined. The discussion covers the layout, interconnection and functionality of the various zones inside the museum. The tasks in designing architectural and artistic solutions for museum complexes are perhaps one of the most difficult in environmental design. Here it is necessary to take into account functionality, ergonomics, aesthetics, subordinating them to the general concept of the museum complex, considering the regularity of the location of objects, the movement of visitor flows, the zoning of space, taking into account the safety and preservation of cultural objects. The article highlights the design features of the museum space of the XX–XXI centuries, taking into account historical changes, political realities, stylistic trends and trends in art.

Degenerate complex Monge-Ampère type equations on compact Hermitian manifolds and applications

In this paper, we show the existence and uniqueness of bounded solutions of the degenerate complex Monge-Ampère type equations on compact Hermitian manifolds and obtain the asymptotics of these solutions. As applications, we give partial answers to the Tosatti-Weinkove conjecture and Demailly-Păun conjecture.

Fostering reflective impact orientation in transdisciplinary research–A multi-method workshop format

The primary objective of transdisciplinary research (TDR) is to contribute to the solution of complex ‘real-world’ problems by integrating heterogeneous knowledge and achieving societal effects. However, establishing a continuous impact orientation during TDR processes remains a challenge, as the necessary tools are not yet sufficiently available.We developed and tested a half-day workshop format for strengthening the impact-oriented project management and research activities of seven TDR projects. Our findings indicate that the reflective impact workshops supported participants in pursuing societal effects systematically. Applying the methodological approach also fosters TDR process qualities such as knowledge integration. Conducted at different project stages, the results can serve as a basis for monitoring and adapting the project design.The reflective approach•includes scientific and non-scientific TDR project team members,•draws on Theory of Change as a conceptual framework and motivates participants to reflect on plausible impact pathways and make implicit assumptions about interlinkages between different forms of societal effects explicit, and•provides results which enable project partners to adjust their project design for greater societal effectiveness.

КІНЕТИКА КОМПЛЕКСОУТВОРЕННЯ 2-МЕТОКСИФЕНОЛУ З ЙОНОМ ФЕРУМУ (III) ТА ЙОНОМ ГЕКСАЦІАНОФЕРУМУ (III)

Study of the formation of complexes of 2-methoxyphenol with ferrum (III) ion or hexacyanoferrum (III) ion. Kinetic studies have shown that the order of reaction for ferrum ion or ferrum hexacyanoion is close to one. The order of reaction for 2-methoxyphenol is 0.8 in the reaction with ferrum (III) ion and close to zero in the reaction with ferrum (III) hexacyanoion. It has been shown that the formed complexes are stable in acidic solution at pH less than 7 and rapidly decompose in alkaline solution. The complex of iron ion with 2-methoxyphenol decomposes into 2-methoxyphenol and ferrum hydroxide at pH above 8. At the same time, the rapid oxidation of 2-methoxyphenol is observed with increasing pH of the solution of the hexacyanoiron ion complex with 2-methoxyphenol. The found Kp values for the interaction of ferrum ion with 2-methoxyphenol are much higher than for the reaction with hexacyanoferrum ion.

SYNTHESIS AND STUDY OF THE OPTICAL PROPERTIES OF THE COLLOIDAL FORM OF IRON WITH RIBOFLAVIN AND L-LYSINE

This paper presents the results of the development and study of a colloidal complex of the essential microelement iron with vitamin B2 riboflavin and the essential amino acid L-lysine. As a result, a method for obtaining a colloidal vitamin-microelement-amino acid complex has been developed, which is carried out in 2 stages. As a result of computer quantum chemical modeling, the most optimal configuration for the interaction of the components of the colloidal complex was determined. Namely, it was found that the connection of riboflavin with the iron ion occurs through oxygen at C4 and nitrogen N3, and lysine binds to the iron ion through the carboxo and amino group in α- position. The optical characteristics of the resulting compound were studied. From an analysis of the absorption spectrum of a 0.001% aqueous solution of an iron complex with riboflavin and L-lysine, the presence of 4 maxima in the spectrum with positions at 222, 265, 374 and 436 nm was established. In the spectrum, the absorption maximum at a wavelength of 436 nm corresponds to the auxochromic amino group; its hypsochromic shift by 20 nm relative to the absorption spectrum of pure riboflavin confirms the formed bond of the amino group with the iron ion in the complex molecule. The fluorescence maximum is located at a wavelength of 522 nm, which corresponds to intense green-yellow fluorescence in both a solution of pure riboflavin and a colloidal iron complex with riboflavin and L-lysine. Analysis of the histogram of the size distribution of micelles of the complex showed the presence of one phase with a size of about 96 nm, which allows us to define the resulting iron complex with riboflavin and the amino acid L-lysine as a colloidal system. For citation: Blinov A.V., Golik A.B., Rekhman Z.A., Gvozdenko A.A., Kolodkin M.A., Bakholdina T.N. Synthesis and study of the optical properties of the colloidal form of iron with riboflavin and L-lysine. ChemChemTech [Izv. Vyssh. Uchebn. Zaved. Khim. Khim. Tekhnol.]. 2024. V. 67. N 7. P. 96-102. DOI: 10.6060/ivkkt.20246707.6999.

Transdisciplinary Research in Marine Science: What’s the added value of involving stakeholders?

The holistic solution of complex, global problems in marine topics requires innovative research formats - which can be served by transdisciplinarity. To assess the success of the transdisciplinary approach for marine research, several case studies from marine research at Kiel University (Germany) were analysed for this study. Interviews with both scientists and stakeholders were carried out to 1) clarify whether stakeholder involvement in scientific projects provides additional knowledge and to 2) identify the underlying success factors. Both groups see added value in transdisciplinary projects and name positive aspects of cooperation, mutual interaction and information exchange. Essential are the applicability of research results, and the formation and maintenance of networks enabling further joint activities. Stakeholders add practical contexts to scientific knowledge so that the results of this transdisciplinary research can be translated into practical actions. Resource availability sets clear limits within the project framework. Successful transdisciplinary approaches require standardized definitions of terms, the selection of suitable participation formats and continuous, clear communication. Transdisciplinary projects proved suitable as a tool for sensitizing the general public and raising awareness of complex marine challenges.

Probing Ion-Receptor Interactions in Halide Complexes of Octamethyl Calix[4]Pyrrole.

Ion receptors are molecular hosts that bind ionic guests, often with great selectivity. The interplay of solvation and ion binding in anion host-guest complexes in solution governs the binding efficiency and selectivity of such ion receptors. To gain molecular-level insight into the intrinsic binding properties of octamethyl calix[4]pyrrole (omC4P) host molecules with halide guest ions, we performed cryogenic ion vibrational spectroscopy (CIVS) of omC4P in complexes with fluoride, chloride, and bromide ions. We interpret the spectra using density functional theory, describing the infrared spectra of these complexes with both harmonic and anharmonic second-order vibrational perturbation theory (VPT2) calculations. The NH stretching modes of the pyrrole moieties serve as sensitive probes of the ion binding properties, as their frequencies encode the ion-receptor interactions. While scaled harmonic spectra reproduce the experimental NH stretching modes of the chloride and bromide complexes in broad strokes, the high proton affinity of fluoride introduces strong anharmonic effects. As a result, the spectrum of F-·omC4P is not even qualitatively captured by harmonic calculations, but it is recovered very well by VPT2 calculations. In addition, the VPT2 calculations recover the intricate coupling of the NH stretching modes with overtones and combination bands of CH stretching and NH bending modes and with low-frequency vibrations of the omC4P macrocycle, which are apparent for all of the halide ion complexes investigated here. A comparison of the CIVS spectra with infrared spectra of solutions of the same ion-receptor complexes in d3-acetonitrile and d6-acetone shows how ion solvation changes the ion-receptor interactions for the different halide ions.

A time-domain integration method with equivalent complex damping model based on viscoelastic material constitutive relation

The complex damping model is only applied in frequency-domain. Based on the constitutive relation of viscoelastic materials, a vibration equation is equivalent to the constitutive relation of complex damping theory and the frequency response function satisfying the causality constraint. Compared with the existing equivalent complex damping model, the proposed equivalent damping model can consider more natural frequencies. The calculation formulas of Gauss precise integral method and improvement constant average acceleration method are derived. By the equivalent complex damping, the seismic time-history response of the typical example could carry on the numerical calculation. Compared with the Gauss precise integral calculation results of complex damping vibration equation, some conclusions can be analyzed. The proposed two methods could avoid divergent phenomenon in the time-domain numerical solution of complex damping vibration equation. The time-domain integral method of equivalent complex damping theory is stable and convergent. The Gauss precise integral method has strong equivalence and big computational complexity. The improvement constant average acceleration method has weak equivalence and small computational complexity.