Contents

Russian Journal of Physical Chemistry A


Vol. 98, No. 4, 2024


PROBLEMS, DEVELOPMENTAL TRENDS, AND CURRENT PROBLEMS OF PHYSICAL CHEMISTRY

Resolving the Paradox of the Dirac Equation through Phenomenology

S. F. Timashev p. 521  abstract


CHEMICAL THERMODYNAMICS AND THERMOCHEMISTRY

Phase Equilibrium in an Octadecane–Propane/n-Butane System

I. Sh. Khabriev, V. F. Khairutdinov, T. R. Akhmetzyanov, L. Yu. Yarullin, and I. M. Abdulagatov p. 531  abstract

Complexation of Silver(I) with 1-Methyl-2-mercaptoimidazole in the Aqueous Dimethylsulfoxide Solvent

A. S. Sodatdinova, S. M. Safarmamadzoda, T. R. Usacheva, and K. S. Mabatkadamzoda p. 538  abstract


CHEMICAL KINETICS AND CATALYSIS

Influence of the Nature of Promoted Zirconium Supports on the Catalytic Behavior of Rh-Based Catalysts in the Reaction of Cyclohexane Ring Opening to n-Hexane

K. E. Kartavova, M. Yu. Mashkin, K. B. Kalmykov, G. I. Kapustin, O. P. Tkachenko, I. V. Mishin, S. F. Dunaev, and A. L. Kustov p. 543  abstract

Oxidative Degradation of Paracetamol by N-Bromo Succinimide in Presence of Mercuric Acetate–A Computational Screening and Mechanistic Pathway

Deepmala Pareek, Asha Rolaniya, Akta Yadav, and Riya Sailani p. 552  abstract

Study on the Crystallization Kinetics of Sodium Chloride in a Stirred Type Crystallizer

Yayuan Zheng p. 560  abstract

Crystallization Kinetics of Potassium Sulfate Produced by Stirred Crystallization

Yayuan Zheng p. 568  abstract


PHYSICAL CHEMISTRY OF SOLUTIONS

Study of the Process of Complex Formation between Cu2+ Ion and L-Aminopropionic Acid in Aqueous Solution

G. B. Eshova, J. A. Davlatshoeva, F. Miraminzoda, and M. Rakhimova p. 577  abstract

Nature of Interaction of Some Carboxylic Acids with the Surface of Dispersed Ice from Aqueous Solutions Against the Background of KCl

V. I. Fedoseeva p. 583  abstract

Methanol Inhibition of Sonochemistry: A Microscopic Investigation of Single Bubble Effects

Aissa Dehane, Slimane Merouani, and Oualid Hamdaoui p. 587  abstract


STRUCTURE OF MATTER AND QUANTUM CHEMISTRY

Estimation of the Dissociation Energies of Donor–Acceptor Complexes of Group 13–15 Element Compounds within the Framework of the Statistical EC Model

D. A. Doinikov, A. S. Zavgorodnii, and A. Yu. Timoshkin p. 601  abstract

Structure of Propyl-, Dipropyl-, and Tripropylammonium Mesylates According to the Molecular Dynamics Data

I. V. Fedorova, M. A. Krest’yaninov, and L. P. Safonova p. 609  abstract

An Effective Algorithm of the Hartree–Fock Approach with the Storing of Two-Electron Integrals in the Resolution of Identity Approximation

I. O. Glebov, and V. V. Poddubnyi p. 617  abstract

Crystal Structure and Toxicity of the Polymorphic Modifications of the Rodenticide Difenacin

A. N. Kochetov, L. A. Nosikova, Z. A. Kudryashova, V. V. Chernyshev, V. A. Tafeenko, S. F. Dunaev, and A. Yu. Tsivadze p. 626  abstract

Solvation State of 18-Crown-6 Ether in Nonaqueous Solvents: Quantum-Chemical Calculations

I. A. Kuz’mina, and M. A. Kovanova p. 637  abstract

X-ray Photoelectron Spectroscopy of 1-Butyl-3-ethylimidazolium Ionic Liquids: The Impact of Ethyl Group on the Electronic Environment of the Cation and the Anion

Binlei Lyu, Shuang Men, Yanhui Liu, and Li Wei p. 641  abstract

Influence of High Pressure on Structural, Electronic, and Optical Properties of Cyclopentane

Jin Wu, and Jian Geng p. 646  abstract

First-Principles Investigations of Structural, Elastic, Mechanical Properties of ZnCr2S4 under Pressure

Lingping Xiao, and Xiaojie Yi p. 654  abstract

A Computational Insight on the Effect of Doping of Transition Metals and Group V Elements on the Electronic Properties of Phosphorene

Roghayeh Mirzaei, Mohammad Reza Zardoost, and Mohammad Reza Toosi p. 661  abstract

The Implications of Pressure on Mechanical and Thermodynamic Properties of Ni2X (X = Sc, Ti, V)Al: DFT Calculation

Tahsin Özer, and Nihat Arıkan p. 669  abstract

A DFT+U Study on Surface Properties and Methane Adsorption Performance of Au1/ZrO2 Single-Atom Catalysts

Xuefeng Wang, Ying Zhu, Shuangli Du, Wenhao Deng, Cunbao Deng, and Huijie Hu p. 683  abstract

Optoelectronic Property Exploration in SnS2 Monolayer and Homojunctions with Non-metallic Element (B, C, N) Doping: A First-Principles Investigation

Xinying Tang, Lu Yang, and Jinlin Bao p. 697  abstract


CHEMOINFORMATICS AND COMPUTER MODELING

1,2,4-Triazol 4-Bromobenzenesulfonates: Synthesis, Characterization (IR, NMR), DFT, Enzym Activities, and Docking Study

Reşat Ustabaş, Fatih Çelik, Nevin Süleymanoğlu, Halil İbrahim Güler, Fikret Türkan, Ercan Oğuz, and Yasemin Ünver p. 707  abstract


PHYSICAL CHEMISTRY OF DISPERSED SYSTEMS AND SURFACE PHENOMENA

Effects of the Indirect Correlations of Interacting Particles on the Mono- and Bimolecular Adsorption and Desorption Rates during Chemisorption

E. V. Votyakov, and Yu. K. Tovbin p. 720  abstract

Determination of the Phase Region and Two-Phase Equilibrium of the Fluid in Pore Spaces

E. S. Zaitseva, and Yu. K. Tovbin p. 729  abstract


PHYSICAL CHEMISTRY OF DISPERSED SYSTEMS AND SURFACE PHENOMENA

Using Laser Desorption/Ionization to Study Heteropoly Acids

I. V. Minenkova, A. M. Emel’yanov, I. G. Tarkhanova, and A. K. Buryak p. 742  abstract


PHYSICAL CHEMISTRY OF SEPARATION PROCESSES. CHROMATOGRAPHY

Equilibrium Concentrations Distribution of Copper(II) with Di-Schiff Base in Hollow Fibers Contactor Membrane

Yamina Boukraa p. 751  abstract


ELECTROCHEMISTRY. GENERATION AND STORAGE OF ENERGY FROM RENEWABLE SOURCES

Transfer Phenomena in Alkali Metal Systems

D. K. Belashchenko p. 758  abstract

New Electrochemical Systems for Sodium-Ion Batteries

T. L. Kulova, I. M. Gavrilin, A. M. Skundin, E. V. Kovtushenko, and Yu. O. Kudryashova p. 771  abstract

Surface Modified Copper Improves the Electrochemical Performance of LiNi0.5Co0.2Mn0.3O2 Cathode Material

Shihang Dai, Jian Zhang, Xuetian Li, Zhongcai Shao, and Zhijiang Liu p. 777  abstract

Electrolytic Preparation and Application of Iron Based Fluoride As Cathode Materials in Lithium Ion Batteries

Zengzeng Zheng, Jin Shi, Min Yao, Chengfei Zhu, and Jinghang Ji p. 787  abstract


PHOTOCHEMISTRY, MAGNETOCHEMISTRY, MECHANOCHEMISTRY

WO3/SrTiO3 Heterojunction Composite: A Promising Photoanode for Photochemical Cathodic Protection

Yingna Zhao, Xinyue Su, Da Qing, Junqi Peng, Xiaoyu Wang, Jiansheng Wang, and Xiongfeng Zeng p. 795  abstract


BIOPHYSICAL CHEMISTRY AND PHYSICAL AND CHEMICAL BIOLOGY

Role of Functional Groups in the Complexation of Structural Analogs of Aromatic Amino Acids with Pectin

R. Kh. Mudarisova, O. S. Kukovinets, S. V. Kolesov, and I. V. Novoselov p. 805  abstract