Contents

Russian Journal of Physical Chemistry A


Vol. 95, No. 2, 2021


Chemical Thermodynamics and Thermochemistry

Phase Equilibrium, Phase Structure, and Interdiffusion in Polystyrene–Polyphenylmethylsiloxane Polymer Mixtures

A. A. Poteryaev, A. D. Aliev, A. E. Chalykh and A. V. Shapagin p. 225  abstract

Phase Equilibrium in Diantipyrylmethane–Organic Acid–Hydrogen Chloride–Water Systems

O. S. Kudryashova and A. M. Elokhov p. 232  abstract

Thermodynamic Properties of Gd–Sn and Gd–Sn–Ni Melt Systems

V. S. Sudavtsova, M. A. Shevchenko, V. G. Kudin, N. V. Podoprigora, A. S. Kozorezov, L. A. Romanova and M. I. Ivanov p. 237  abstract

Viscosity of Fe–Mn–С Melts

O. A. Chikova, N. I. Sinitsin and V. V. V’yukhin p. 244  abstract

Thermodynamic Properties of a Solution of 2-Ethoxyethanol in Jet Kerosene

M. N. Mamontov and A. P. Oshchenko p. 250  abstract

Thermochemical Properties of Triphenylantimony Bis(phenylpropiolate) Ph3Sb(OC(O)С≡СPh)2

D. V. Lyakaev, A. V. Markin, P. E. Goryunova, N. N. Smirnova, A. V. Knyazev, V. V. Sharutin and O. K. Sharutina p. 258  abstract

Effects of Heat Treatment on Crystallinity, Hydrophilicity, and Photocatalytic Activity of Cd0.2Zn0.8S Solid Solution

Peng Zhang, Liping Zhao and Wenzhe Zhou p. 262  abstract


Chemical Kinetics and Catalysis

Kinetics of Formation of Molecular Hydrogen during the Radiolysis of Hexane and a Mixture of C6H14–H2O on a Surface of ZrO2 Nanoparticles

T. N. Agaev, Sh. Z. Musaeva and G. T. Imanova p. 270  abstract

Solid-State Catalytic Hydrogen/Deuterium Exchange in Mexidol

A. K. Dadayan, Yu. A. Borisov, Yu. A. Zolotarev, E. V. Bocharov, I. Yu. Nagaev and N. F. Myasoedov p. 273  abstract


Physical Chemistry of Solutions

Acid-Base Equilibrium of a 6-Methyluracil Derivative with 1,2,3-Triazole Fragment in Aqueous Solutions

A. A. Akhiyarov, L. M. Gubaidullina, L. F. Saifina, V. E. Semenov, L. A. Ramazanova, A. N. Lobov, I. S. Faizrakhmanov, I. E. Alekhina and S. P. Ivanov p. 279  abstract

Self-Diffusion of Fullerene С60 Derivatives in Aqueous Solutions and Suspensions of Erythrocytes According to Pulsed Field Gradient NMR Data

I. A. Avilova, Yu. V. Soldatova, O. A. Kraevaya, A. V. Zhilenkov, E. A. Dolgikh, R. A. Kotel’nikova, P. A. Troshin and V. I. Volkov p. 285  abstract

Effect of the Composition of Mixed Aqueous Organic Solvents on the Stability of Copper(II) Complexes with Anions of Succinic and Maleic Acids

N. V. Tukumova, N. V. Belova, T. R. Usacheva and Tran Thi Dieu Thuan p. 292  abstract

Effect of the Structure of Imidazolium Ionic Liquids on the Electrical Conductivity and Processes of Ionic Association in Acetonitrile Solutions

O. E. Zhuravlev p. 298  abstract

Analyzing the Size of Albumin Macromolecules in Aqueous Solutions

N. P. Malomuzh and A. V. Khorolskyi p. 303  abstract


Structure of Matter and Quantum Chemistry

Molecular Structures of Heteroligand Macrotetracyclic Complexes of 3d Ions with Phthalocyanine and Fluoride Anion Studied by Density Functional Theory

D. V. Chachkov and O. V. Mikhailov p. 310  abstract

ReaxFF Molecular Dynamics Simulation of the Cracking of Components of Vacuum Gasoil in the Presence of a Nickel Nanocluster

R. Kh. Shayakhmetova and E. M. Khamitov p. 317  abstract

Optical and Magnetic Properties of a Heteroligand Complex of Gadolinium Stearate with Acetyl Acetone

S. N. Ivanin, V. Yu. Buzko, A. I. Goryachko and V. T. Panyushkin p. 326  abstract

The Connection between Pseudo-Jahn–Teller Effect and Electron Delocalization for Proving the Origin of Equilibrium Geometry of Nitrosyl Halides (Halides = Cl, Br, and I)

Ghazaleh Kouchakzadeh p. 332  abstract

Study on UV Spectrum and Antioxidant Properties of 3-tert-Butyl-4-hydroxyanisole Molecule

Bin Shi, Jiancheng Yu, Tianyu Tang, Li Yuan and Yanlin Tang p. 343  abstract

Vibration and FMO Studies of PBA and DBA Liquid Crystals with DFT Method

Ch. Ravi Shankar Kumar and Anjali Jha p. 349  abstract

Molecular Dynamics Simulation of Methyl Ester Sulfonates at the Water/Chloroform Interface

Zhiqiang Li, Junjie Zhou and Chengqiang Zhang p. 357  abstract


Physical Chemistry of Nanoclusters and Nanomaterials

Conformational Changes of Uniformly Charged Polyelectrolyte Chains on the Surface of a Polarized Gold Nanoparticle: Molecular Dynamics Simulation and the Theory of a Gaussian Chain in a Field

N. Yu. Kruchinin, M. G. Kucherenko and P. P. Neyasov p. 362  abstract

Synthesis of Рorous Bimetallic Nanocatalyst for Selective Formate Production by CO2 Еlectroreduction

Rana Rashad Mahmood Khan, Ramsha Saleem and Ahmad Adnan p. 372  abstract

Microporous Polymers Reinforced with Inherent Conjugation for Organic Solvent Nanofiltration

Sayan Basak p. 380  abstract


Physical Chemistry of Surface Phenomena

Mass Spectrometry of the Laser Desorption/Ionization of Magnesium, Tungsten, and Boron Powders before and after Mechanochemical Activation

A. Yu. Sholokhova, A. I. Malkin and A. K. Buryak p. 383  abstract

Adsorption of 2,4-Dichlorophenol and Phenol from Aqueous Solutions by Silicate Sorbent

G. I. Gusev, A. A. Gushchin, V. A. Grinevich, D. V. Fillipov, E. A. Moskalenko and M. A. Shil’ke p. 389  abstract


Physical Chemistry of Separation Processes: Chromatography

Features of the Recurrent Approximation of Retention Parameters of Polyfunctional Compounds in Reversed-Phase High-Performance Liquid Chromatography

I. G. Zenkevich and D. A. Nikitina p. 395  abstract


Short Communications

Metadynamics Study of the Crystallization of Supercooled Lennard-Jones Liquids

V. G. Baidakov, E. O. Rozanov and S. P. Protsenko p. 403  abstract