Contents

Russian Journal of Physical Chemistry A

Vol. 98, No. 5, 2024

XX SYMPOSIUM ON HIGH-RESOLUTION MOLECULAR SPECTROSCOPY (HighRus-2023)

Experiments on Molecular Spectroscopy at the Novosibirsk Terahertz Free Electron Laser

V. V. Kubarev, and E. N. Chesnokov p. 813  abstract

High-Resolution Diatomic Spectroscopy near the Dissociation Threshold

A. V. Stolyarov p. 824  abstract

“Electronic Structure of Atoms” Information System for Atomic Spectroscopy

V. V. Kazakov, V. G. Kazakov, O. I. Meshkov, and A. S. Yatsenko p. 828  abstract

Molecular Rotation and Generalized Euler Equations

S. V. Petrov p. 837  abstract

On the Vector Model of Transformation of the Kinetic Energy Operator of Multiparticle Systems to the Description of Internal Motions

B. K. Novosadov p. 847  abstract

On the Physical Meaning of the Parameters of Intermolecular Interaction Potentials in the Asymptotic Line Wing Theory

O. B. Rodimova p. 854  abstract

Collision-Induced Transformation of the Complex Vibrational Susceptibility of a Linear Molecule Using the Example of the ν3 Band of Carbon Dioxide

A. P. Kouzov, N. N. Filippov, N. I. Egorova, and R. E. Asfin p. 864  abstract

Asymptotic Behavior of the Rydberg States of Molecular Hydrogen in the Limit of a United Atom

A. S. Likharev, E. A. Pazyuk, and A. V. Stolyarov p. 870  abstract

A Study of the Ionization Spectrum of 6,6-Dimethylfulvene Using Algebraic-Diagrammatic Construction and Coupled Cluster Methods

A. B. Trofimov, A. D. Skitnevskaya, A. M. Belogolova, E. K. Iakimova, and E. V. Gromov p. 878  abstract

Non-Empirical Calculations of Reduced Quartic, Sextic, and Octic Constants of Effective Vibrational–Rotational Hamiltonians, Based on the Operator Perturbation Theory

I. M. Efremov, D. V. Millionshchikov, and S. V. Krasnoshchekov p. 886  abstract

Effect of Repulsive Electronic States on the Parameters of the Fine Structure of the Ground Electronic State of an OH Radical

S. V. Kozlov, E. A. Pazyuk, and A. V. Stolyarov p. 897  abstract

Calculation of Vibrational-Rotational Transition Frequencies and RKR Potentials of the HBr Molecule

T. I. Velichko, and S. N. Mikhailenko p. 904  abstract

Two-Temperature Analysis of Intensity Distribution in the Rovibronic Spectra of the CN Radical

V. A. Terashkevich, and E. A. Pazyuk p. 912  abstract

The PQN-Code Program Based on Polynomials of Quantum Numbers for Calculating the Centers of Lines in Infrared Spectra of Polyatomic Molecules and Matrix Elements of a Dipole Moment

M. Yu. Yur’ev, V. M. Vakhromov, A. O. Voloshchenko, and L. B. Klink p. 920  abstract

Features of the Conformational Dynamics of Cyclopropanoic Acid Fluoride and Cyclopropanoic Acid Chloride Molecules in the Ground Electronic State

G. A. Akimov, V. A. Bataev, and S. S. Styopin p. 929  abstract

Internal Rotation in Aldehydes Containing Four-Membered Rings

V. A. Bataev, and S. S. Styopin p. 936  abstract

Noncovalent Interactions between Volatile Anesthetics (Enflurane, Isoflurane) and Dimethyl Ether. Spectroscopic Demonstration of Trimer Formation

K. S. Rutkowski, and S. M. Melikova p. 942  abstract

Millimeter Range Spectrometer for Studying Molecules and Weakly Bound Complexes in Supersonic Gas Jet

I. V. Tarabukin, V. A. Panfilov, D. G. Poydashev, and L. A. Surin p. 948  abstract

Measurement of Singlet Oxygen Concentration in the Ambient Atmosphere

Yu. A. Adamenkov, A. A. Kalacheva, V. A. Shaidulina, and M. A. Gorbunov p. 953  abstract

Using Different Spectroscopic Databases to Model the Transfer of Radiation in the Near-IR Range and Retrieve the Content of Methane in the Atmosphere

T. Yu. Chesnokova, A. V. Chentsov, K. G. Gribanov, I. V. Zadvornykh, and V. I. Zakharov p. 957  abstract

Parameters of Absorption Lines of Water Molecules in the Spectral Region of 4500–4700 cm–1

V. M. Deichuli, T. M. Petrova, A. M. Solodov, A. A. Solodov, T. Yu. Chesnokova, and A. V. Chentsov p. 966  abstract

PROBLEMS, TENDENCIES IN DEVELOPMENT, AND CHALLENGES IN PHYSICAL CHEMISTRY

Effect of Crystallographic Orientation on the Initial Corrosion Behavior of Pure Aluminum in NaCl Solution

C. Chen, X. R. Xiang, Y. Xie, Y. W. Liu, G. J. Han, Z. X. Zhuo, and Y. Chen p. 973  abstract

STRUCTURE OF MATTER AND QUANTUM CHEMISTRY

Aqueous Degradation of Flumequine Induced by Hydroxyl and Sulfate Radicals: A Theoretical Research

Xiaolan Zeng, Xueli Wang, Shuang Shu, and Yan Wang p. 981  abstract

X-ray Photoelectron Spectroscopy of Cyano-Containing Ionic Liquids: C 1s Fitting Model and Impact of Anion Charge Delocalization on Binding Energies

Xin Li, Mingwei Du, Li Wei, and Shuang Men p. 990  abstract

Evolution of the Material Properties of Rice Husk Hydrochar under Process Water Recycling and Its Adsorption Performance Research for Malachite Green

Yan Ding, Chuwen Guo, Debo Li, Maochao Lv, Xiaowei Zhang, Didi Gai, Binbin Fu, Shuairong Yang, and Peitao Zhao p. 997  abstract

PHYSICAL CHEMISTRY OF NANOCLUSTERS, SUPRAMOLECULAR STRUCTURES, AND NANOMATERIALS

Investigations on Giant Electrocaloric Effect in BaTiO3 Nanoceramics

M. A. Hamad, and H. R. Alamri p. 1009  abstract

Synthesis of Nickel–Tungsten Bimetallic Carbide Nanoparticles for the Hydrodeoxygenation of Benzofuran

Yue Zhao, Mingming Zhang, Shixiong Zhao, and Rong Liu p. 1014  abstract

CHEMOINFORMATICS AND COMPUTER MODELING

Theoretical Insights into the Intermolecular Behavior of Hydrocortisone with Two Acceptors

Can Wang, Chenyang Zou, Cuixia Yao, and Zongjin Qu p. 1025  abstract

3-Methoxy- and 3-Ethoxysalicylaldehydes: Structural, DFT, and Optical Studies, and in Silico Prediction of the Antiviral Activity

D. A. Safin p. 1029  abstract

Adsorption and Diffusion Behavior of Xe/Kr Gas on Al2O3 and Stilbene Surface

Jingxiao Wang, Qianhao Lan, Fei Luo, Qian Wang, and Hongyan Wang p. 1050  abstract

Computational Study of an Inductively Coupled Plasma with Different Copper Coil Designs and Dielectric Thickness

E. Poorreza, and N. Dadashzadeh Gargari p. 1057  abstract

Synthesis and Characterization of New Oxime Ligand and Its Cu(II) Complex: DFT Calculations, in Vitro Antibacterial Activity, Drug-Likeness Properties, and Molecular Docking Studies

Seda Alkan, Tufan Topal, and Emin Karapınar p. 1065  abstract

PHYSICAL CHEMISTRY OF DISPERSED SYSTEMS AND SURFACE PHENOMENA

Benzene Contaminant Removal from Hydraulic Fracking Water Using Marine Macroalgae Biosorbent: Kinetic and Thermodynamic Study

Ashraf M. Al-Msiedeen, Musab W. Alsagarat, Ali Al-Nawaiseh, and Rasheed M. Jamhour p. 1076  abstract

ELECTROCHEMISTRY. GENERATION AND STORAGE OF ENERGY FROM RENEWABLE SOURCES

Electrochemical Study of K+-Doped LiNi0.5Co0.2Mn0.3O2 Prepared by Co-Precipitation Freeze-Drying Method

Bingte Wang, Yongqi Dai, Xiaojie Yang, Zhongcai Shao, and Xuetian Li p. 1091  abstract