Contents

Russian Journal of Physical Chemistry B

Vol. 19, No. 2, 2025

STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY

Density Functional Theory Exploring of Substitution and Isotopic Effects on the Adsorption of Pyridine on Mg4O4 Cluster

M. T. Jam, R. Ghiasi, and S. Baniyaghoob p. 271  abstract

First Principle Investigation by Hybrid Functional Method on the Physical Properties of Narrow Band Gap ScxY1–xN (0 ≤ x ≤ 1) Solid Solutions

N. E. I. Zeghoum, S. Lakel, and K. Almi p. 277  abstract

Study on the Interaction of Olmesartan with Human Serum Albumin by Spectroscopic and Molecular Docking Techniques

M. Shalbafan, M. Sadeghpour, and A. Olyaei p. 287  abstract

Structure and Properties of Matter—Additive Approach

V. Dimitrov, and L. Eppelbaum p. 294  abstract

Synthesis, Density Functional Theory Investigation, Antioxidant and Antibacterial Activities Evaluation of Hydroxybutyl and Hydroxypropyl Aminophosphonic Acids

A. Bouchama, A. Hellal, A. Madani, H. Layaida, I. Kirouani, and I. Haddadi p. 300  abstract

Divulge of Hydrogen Energy Storage by Manganese Doped Nitrogen Nanocomposites of Aluminum, Gallium or Indium Nitrides: A First-Principles Study

F. Mollaamin, and M. Monajjemi p. 319  abstract

Comparative Study of Electronic Structure and Photophysical Properties of Some New Lawsone Dyes in Dye-Sensitized Solar Cells by DFT and TD-DFT

A. Olyaei, F. Zanjanchi, M. Farzogi, and M. Sadeghpour p. 336  abstract

Computational Studies on Maraviroc Derivatives for HIV Treatment: QSAR and Molecular Docking Approaches

R. Sayyadi Kordabadi, S. A. S. Hashemi, and O. Alizadeh p. 348  abstract

KINETICS AND MECHANISM OF CHEMICAL REACTIONS, CATALYSIS

The Effect of Temperature on the Cool-Flame Oxidation of Rich Propane-Oxygen Mixtures

M. Dj. Poghosyan, N. M. Poghosyan, S. D. Arsentev, L. N. Strekova, and V. S. Arutyunov p. 362  abstract

Influence of CTAB and SDS on the Oxidation of Leucine by Quinolinium Dichromate in Presence of HClO4

P. Meena, K. Meena, Dhanraj, and M. B. Yadav p. 368  abstract

ELECTRIC AND MAGNETIC PROPERTIES OF CHEMICAL COMPOUNDS

Room Temperature Liquefied Petroleum Gas Sensing Based on Reduced Graphene Oxide Thin Film

M. Taheri p. 379  abstract

Solid-State Lithium-Ion Batteries Based on Using Ionics Conductivity Polymers Interfaces during Interaction between Solid Electrolytes with Both Electrodes

M. Monajjemi, F. Mollaamin, M. Dehghandar, R. Tohidloo, G. Arab, and S. Shahriari p. 388  abstract

Experimental Study as Well as DFT Calculations for Ion Transport in Hydrogen/Platinum/Iridium Electrode of Fuel Cells through h-BN Layers in Proton Exchange Membrane

M. Monajjemi, F. Mollaamin, Y. Shahverdy, and S. Shahriari p. 401  abstract

Experimental and Theoretical Study of metal Doped Dielectric Capacitors Composd with M–GO/(h-BN)n/M–GO(M = Be, B): A High Capacitance at Micro-Scale

M. Monajjemi, F. Mollaamin, S. Shahriari, and S. Mohammadi p. 417  abstract

PHYSICAL METHODS FOR INVESTIGATION OF CHEMICAL PROCESSES

Thermal Stability of Liquid Crystalline Hydroxamic Acid Derivatives

C. Sharma, N. Pandya, S. Shukla, and Y. Agrawal p. 432  abstract

CHEMICAL PHYSICS OF BIOLOGICAL PROCESSES

Calculations of the Electronic Properties and Absorption of the Carmustine Anticancer Drug Molecule on the Surface of Single-Walled Carbon Nanotubes (8,0) Using Density Functional Theory

M. Kia, and N. Bakhshi p. 442  abstract

CHEMICAL PHYSICS OF ECOLOGICAL PROCESSES

Electrocatalytic Conversion of CO2 to Formate on a Pb–Graphite Composite Electrode

Basel Al-Saida p. 453  abstract

CHEMICAL PHYSICS OF NANOMATERIALS

Polypyrrole-Coated Cobalt Ferrite Nano-Sorbent for Efficient Removal of Fast Green Dye: A Kinetic and Thermodynamic Approach

M. K. Goswami, and A. Srivastava p. 466  abstract

Unraveling Hetero-Clusters of Indium Gallium Nitride and Its Alloys for Solar Cells Development: Structural and Characterization Study of Nitride-Based Semiconductors Using DFT Framework

F. Mollaamin, and M. Monajjemi p. 480  abstract

Effects of ZnO-Doping on the Morphology and Mechanical Properties in TiO2/SiO2 Nanocomposite Thin Films Via Sol–Gel Process for Coating Application

C. X. Thang, and N. T. Giang p. 501  abstract

REACTIONS ON SURFACE

Adsorption of H2O Molecules Mechanism on Graphene-Like ZnO Monolayer with Promoted Humidity Sensing Performance

H. Wang, J. Liu, W. Tai, and J. Chen p. 507  abstract

Retardation of Perovskite Crystal Growth by Lead Thiocyanate Addition and Its Effect on Perovskite Solar Cell Performance

G.-J. Han, P. Kim, K.‑S. Sonu, and J.‑H. Ri p. 512  abstract

Erratum

Erratum to: Two-Stage Thermal and Heterogeneous Catalytic Conversion of Hydrolysis Lignin in Supercritical n-Hexane

N. A. Bobrova, A. E. Koklin, T. V. Bogdan, N. V. Mashchenko, A. M. Korotaeva, S. E. Bogorodskii, and V. I. Bogdan p. 520  abstract