Himičeskaâ fizika

ISSN(Print): 0207-401X

Media registration certificate: No. 0110275 dated 02/09/1993

Founder: Russian Academy of Sciences, Federal Research Center for Chemical Physics named after. N.N. Semenov RAS

Editor-in-Chief: Buchachenko Anatoly Leonidovich

Number of issues per year: 12

Indexation: RISC, list of Higher Attestation Commissions, CrossRef, White List (level 2)

The journal publishes articles on the following topics:

- elementary physical and chemical processes

- structure of chemical compounds, spectroscopy, quantum chemistry

- reactivity, influence of external fields and environment on chemical transformation

- molecular dynamics and molecular organization

- dynamics and kinetics of photo- and radiation-induced processes

- mechanism of chemical reactions in the gas and condensed phases and at interphase boundaries

- chain and thermal processes of ignition, combustion and detonation in gases, in two-phase and condensed systems

- shock waves

- physical methods for the study of chemical reactions

- biological processes in chemical physics

The journal is designed for researchers, graduate students and students specializing in the study of the kinetics and mechanism of chemical reactions, energy transfer processes, the structure of matter, catalysis, combustion and detonation processes, transformations in shock waves

The journal is designed for researchers, graduate students and students specializing in the study of the kinetics and mechanism of chemical reactions, energy transfer processes, the structure of matter, catalysis, combustion and detonation processes, transformations in shock waves.

Current Issue

Open Access Open Access  Restricted Access Access granted  Restricted Access Subscription Access

Vol 44, No 3 (2025)

Cover Page

Full Issue

Open Access Open Access
Restricted Access Access granted
Restricted Access Subscription Access

СТРОЕНИЕ ХИМИЧЕСКИХ СОЕДИНЕНИЙ, КВАНТОВАЯ ХИМИЯ, СПЕКТРОСКОПИЯ

Analysis of the physicochemical and optical characteristics, as well as the adhesion properties of YAG : Ce3+ phosphors for laser illumination devices
Zuev S.M., Prokhorov D.A.
Abstract

The present scientific article encompasses an analysis of the physicochemical and optical characteristics, as well as adhesion properties of two luminescent materials based on yttrium aluminum garnet, doped with cerium. The aim of the study was to determine the potential usage of these luminescent materials in laser lighting devices. To achieve this, the luminescence spectrum and color diagrams were analyzed when the luminescent materials were subjected to laser radiation with various power and current values. The results revealed that both examined luminescent materials possess high luminous efficiency when current is applied. However, after six months of operation, the luminescent systems exhibited differences in their adhesion properties. Additionally, the study produced a block diagram of a device designed to analyze the physicochemical parameters of laser luminescent systems under the influence of laser radiation with λ = 405–450 nm. With the aid of this device, data on the characteristics of the luminescent materials under different current values were obtained, providing a more precise control over their degradation processes. The investigation demonstrated that both examined luminescent materials can be utilized in laser lighting devices, but one of the luminescent material samples proved to be a more stable and durable material due to its better adhesion with the substrate. The proposed results can be beneficial in the development of new laser lighting tools.

Himičeskaâ fizika. 2025;44(3):3-14
pages 3-14 views

Kinetics and mechanism of chemical reactions, catalysis

Kinetics of the reaction of hydrogen evolution on steel in inhibited phosphoric acid solutions
Avdeev Y.G., Nenasheva T.A., Luchkin A.Y., Panova A.V., Marshakov A.I., Kuznetsov Y.I.
Abstract

The kinetics was studied and the constants of the main stages of hydrogen separation and incorporation into steel in a solution of phosphoric acid containing a mixture of 1,2,4 triazole derivative IFKhAN-92 and KNCS were determined. The addition of IFKhAN-92 + KNCS mixture inhibits the reaction of cathodic reduction of hydrogen and its penetration into steel in H3PO4 solution. The inhibitory effect of this mixture is due to a decrease in the ratio of the hydrogen concentration in the metal phase to the degree of hydrogen filling of the surface. The decrease in the hydrogen concentration in the metal volume by the IFKhAN-92 + KNCS mixture determines the preservation of the plastic properties of steel during corrosion in H3PO4 solutions. The high efficiency of the IFKhAN-92 + KNCS composition, as inhibitors of cathodic reduction of hydrogen and its absorption, is the result of chemisorption of the organic component of the mixture on the surface of steel and the formation of a polymolecular protective layer.

Himičeskaâ fizika. 2025;44(3):15-27
pages 15-27 views
Kinetics and mechanism of decomposition of dibenzoylfuroxane
Nazin G.M., Kazakov A.I., Nabatova A.V., Shilov G.V., Fershtat L.L., Larin A.A.
Abstract

The kinetics of decomposition of dibenzoyl furoxane (DBFO) in a melt and in dilute solutions in biphenyl and nitrobenzene at a temperature of 116–141 °C was studied by the calorimetric method. As a result of the decomposition of DBFO, a substance is formed, which by its nature is also furoxane, but differs in a more complex structure and a higher decomposition temperature. The high rate and unusual composition of the decomposition products of DBFO are explained within the framework of the biradical mechanism of decomposition of furoxanes.

Himičeskaâ fizika. 2025;44(3):28-36
pages 28-36 views

Combustion, explosion and shock waves

Ignition of anthracite by a laser pulse
Aduyev B.P., Nurmukhametov D.R., Liskov I.Y.
Abstract

The ignition of tableted samples (ρ = 1 g/cm3) of microparticles (d ≤ 63 microns) of anthracite by laser pulses (532 nm, 10 ns, (0.15–0.5) 109 W/cm2) was studied. When the critical energy density Hcr(1) ≈ 0.15 J/cm2 is exceeded, an optical breakdown of the sample surface occurs during the laser pulse and the formation of a plasma flare with a lifetime of ≥ 5 microseconds. The amplitude of the plasma glow, depending on the energy density of the laser pulses, is described in the framework of the optical breakdown model. The presence of the following atoms and molecules in plasma was identified by the luminescence spectra: C, C+, Ca+, Fe+, Fe, CN, C2, CO. At a density of H > Hcr(2), in anthracite samples, as in hard coals, thermochemical reactions are initiated in the volume of microparticles, the release and ignition of volatile substances and №n-volatile residue in a submillisecond time interval.

Himičeskaâ fizika. 2025;44(3):37-48
pages 37-48 views
Evaluation of energetic potential of some tetrazine oxides as components of gun propellants. I. Two-component compositions
Astakhov A.M., Lempert D.B.
Abstract

Thermodynamic evaluation of the possibility of using furazanotetrazine dioxide and tetrazinotetrazine tetroxide in two-component compositions with different binders as gun propellants has been carried out. Such compositions allow very high force values, 1750 kJ/kg or more. But this is achieved at the cost of extremely high temperature of combustion products, above 5000 K, which is completely unacceptable for barrel systems. By increasing the binder content it is possible to reduce the temperature of gases to an acceptable level. However, the inevitable drop of force allows to consider such compositions only as mortar propellants, and for other systems the obtained compositions do not exceed the known ones in efficiency.

Himičeskaâ fizika. 2025;44(3):49-58
pages 49-58 views

Электрические и магнитные свойства материалов

Domain-wall excitations in helical phase of spin chain with competing exchange interactions
Krivnov V.Y., Dmitriev D.V.
Abstract

The classical Heisenberg spin chain with competing exchange interactions of ferro-(F) and antiferromagnetic (AF) types has been considered. This model describes qualitatively properties of the edge-sharing cuprates. The model id characterized by the frustration parameter which is a ratio of the AF- and F-interactions. The ground state of the model is either ferromagnetic or singlet with helical spin correlations in dependence of the frustration parameter. The main attention is given to the study of excited states in the helical phase. These states are domain walls separating the regions with opposite chiralities. It is shown that these excitations are gapped and their energy scales the temperature region in which the phase transition from the helical to the ferromagnetic phase takes place. The calculated energies of domain-walls excitations are used for the determination of the Lifshitz boundary on the phase diagram.

Himičeskaâ fizika. 2025;44(3):59-64
pages 59-64 views
Properties of water adsorbed in porous silica gels with different shapes of microparticle
Sergeev A.I., Shilkina N.G., Barashkova I.I., Maklakova I.A.
Abstract

A comparison was made of the relaxation, diffusion and calorimetric characteristics of samples with different water content in the pores of Separon SGX and Silasorb 600 silica gels, which differ in the shape (regular and irregular) of microparticles. It has been shown that the layer of water experiencing the relaxation effect of the surface in the pores has constant dimensions for these silica gels. It has been established that the surface relaxation efficiency, the ratio of relaxation times T1 /T2, which reflects the phase state of water, does not change depending on the water content in the sample. It was found that the patterns of changes in the time of spin-lattice T1 and spin-spin T2 relaxation of water protons, the amount of freezing (FW) and non-crystallizing (NFW) water when changing the moisture content in samples with different shapes of silica gel microparticles have a similar character. The dependence of diffusion coefficients on the water content in silica gels made it possible to calculate the value of the characteristic pore parameter S/V and compare it with the characteristics declared by the manufacturer. The noticeable deviation for Silasorb 600 can be explained both by the difference in the distribution of pore sizes and by the difference in the nature of diffusion processes, which is a consequence of the irregular shape of the microparticles.

Himičeskaâ fizika. 2025;44(3):65-78
pages 65-78 views

Chemical physics of biological processes

Kinetics of the reaction of phosphoenol pyruvic acid with tetranitrosyl iron complex with penicylamine ligands – nitrogen monoxide donor
Psikha B.L., Saratovskikh E.A., Sanina N.A.
Abstract

The kinetic patterns of the reaction of phosphoenolpyruvic acid (PEP) with the NO donor – nitrosyl iron complex with penicillamine ligands (PEN) were studied using mass spectrometric analysis. It has been established that the PEP molecule in an aqueous solution interacts with PEN. The kinetic curves demonstrate the complex multi-stage nature of the reaction. A kinetic model of the process is proposed that quantitatively describes the experimental data.

Himičeskaâ fizika. 2025;44(3):79-86
pages 79-86 views

Химическая физика экологических процессов

Peculiarities of the effect of manganese and cadmium ions on the properties of liposomes from lecithin
Beletskaya P.D., Dubovik A.S., Shvydkiy V.O., Shishkina L.N.
Abstract

The features of the influence of divalent cadmium and manganese ions on the ability of lecithin to form aggregates in water medium, its ζ-potential, and the state of the lipid peroxidation processes have been studied. The methods used were TLC, dynamic light scattering, and processing of UV spectra using the Gauss method. It was revealed that cadmium ions accelerate the processes of lipid oxidation in liposomes, and manganese ions inhibit them. At the same time, cadmium ions, as opposed to manganese ions, require more period to interact with the membrane structure of liposomes. The data obtained and the analysis of the literature allow us to conclude that the cadmium and manganese ions present in the solution influence the spontaneous aggregation of lecithin and participate at different stages of the oxidation process in accordance with their biological activity when entering the body.

Himičeskaâ fizika. 2025;44(3):87-96
pages 87-96 views
Mechanism of effect of the zinc and lead ions on state of the oxidation processes in liposomes from lecithin
Mashukova A.V., Dubovik A.S., Shvydkiy V.O., Shishkina L.N.
Abstract

The influence of divalent zinc and lead ions in a wide range of concentrations on the ability of soy lecithin to spontaneous aggregation in water medium, the zeta potential of he formed liposomes, the ability of metal ions to interact with membranes and their participation in the processes of the lipid peroxidation were studied using the method of dynamic light scattering and mathematical processing of UV-spectra of lecithin and its mixtures with metal ions. It has been shown that the scale and direction of the impact of zinc and lead ions corresponds to their biological activity when entering the body. The data obtained and the analysis of the literature allow us to conclude that the effect of zinc ions at high concentrations on the structural state of membranes and their electrophoretic properties and a significant change in the parameters of the lipid peroxidation regulation system in biological objects in the presence of lead ions, even at low doses, are the basis of their toxicity for biological objects.

Himičeskaâ fizika. 2025;44(3):97-105
pages 97-105 views

ХИМИЧЕСКАЯ ФИЗИКА НАНОМАТЕРИАЛОВ

Magnetic nanoparticles as a platform for delivery of the photosensitizer methylene blue to HCT116 tumor cells
Nguyen M.T., Markova A.A., Batchaeva B.B., Gorobets M.G., Toroptseva A.V., Motyakin M.V., Abdullina M.I., Bychkova A.V.
Abstract

Hybrid nanosystems based on magnetic iron oxide nanoparticles (IONPs) and human serum albumin (HSA), containing methylene blue (MB) as a model photosensitizer, have been synthesized. The resulting HSA@IONP nanosystems were characterized for size and composition using UV/visible spectrophotometry (particularly, using the Bradford method), dynamic light scattering, and electron magnetic resonance. A study of the dark and photoinduced cytotoxicity of MB, IONP, HSA@IONP, MB–IONP, MB–(HSA@IONP) on of human colon adenocarcinoma HCT116 cells was carried out. Under the experimental conditions, the difference between the dark and light-induced cytotoxicity of nanosystems on cells was significantly enhanced when the photosensitizer was immobilized on the surface of the carrier particles compared to free photosensitizer in equivalent concentrations.

Himičeskaâ fizika. 2025;44(3):106-110
pages 106-110 views