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Effect of the Size Factor on the Lattice Parameter Effect of the Size Factor on the Lattice Parameter and the Debye Temperature of Iron Alloys Doped with Chromium or Vanadium
Russian Metallurgy (Metally). 2013. No. 1. P. 18–24.
Translator: K. Shakhlevich
For modelling thermodynamic properties of the Fe–Cr alloys necessary to know the concentra tion dependences of the Debye temperature, the lattice parameter, the elastic moduli, the average magnetic moment, and the Curie temperature. The investigations are performed on iron alloys with chromium or vana dium in the concentration range 2–8 at %. The lattice parameters of the alloys are determined by comparing them with a standard sample placed on the surface of the sample under study. As the standard, a silicon crystal is used, and its lattice parameter is measured by the highprecision Bond method. The Debye temperatures of the alloys are determined from the temperature dependences of the integrated Xray diffraction line inten sities. The specific magnetization is measured by the Faraday method to compare the magnetic properties of Fe–Cr and Fe–V alloys. The partial magnetic moment of the iron atom is shown to increase with the alloy ingelement concentration.
Гущина В. А., / Series chemrxiv-2023-vpzhz-v2 "ChemRxiv". 2023.
All-inorganic perovskite CsPbBr3 and Cs4PbBr6 nanoparticles are being intensively studied due to their unique properties and wide range of applications; however, however, the nature of their optical properties is not yet fully understood due to the difficulty of synthesis of singlephase nanoparticles. In this article we describe the features of the synthesis of single-phase particles ...
Added: May 14, 2026
Pilé I., Deng Y., Shchur L., / Series arXiv "math". 2026. No. 2604.10254.
We investigate the spatial overlap of successive spin configurations in Markov chain Monte Carlo simulations using the local Metropolis algorithm and the Svendsen-Wang and Wolff cluster algorithms. We examine the dynamics of these algorithms for two models in different universality classes: the Ising model and the Potts model with three components. The overlap of two ...
Added: April 20, 2026
Dmitry Vasilyev, Journal of Physics: Conference Series 2021 Vol. 1942 Article 012017
In this work, structural, elastic and thermal properties of the Laves phase Fe2Mo (λ-) with the C14-type structure existing in the Fe – Mo system have been investigated using the quantum mechanical calculations within the frame of the density functional theory (DFT). The equilibrium lattice parameters, atoms position coordinates and average magnetic moment of atoms ...
Added: July 26, 2025
Vasilyev Dmitry, Physica B: Condensed Matter 2021 Vol. 621 No. 15 Article 413307
In this work, a new method of searching a most energetically favorable free energy calculated along different thermal expansion paths of a compound is proposed. This makes it possible to reduce the problem to a one-dimensional case and to consider free energy as having one variable - volume. The method was applied to study the ...
Added: July 25, 2025
Dmitry Vasilyev, Physica Status Solidi (B): Basic Research 2023 Vol. 260 No. 1 Article 2200222
The thermal expansion path is calculated for the Co7Mo6 compound, with the structure of μ-phase, from T = 0 to 1500 K which is below its decomposition temperature. The method allowing to reduce the problem to a 1D case and considering the energy as depending on only one variable, the volume, is used. The thermodynamic properties of Co7Mo6 ...
Added: July 25, 2025
Dmitry Vasilyev, Physical Chemistry Chemical Physics 2024 Vol. 26 P. 3482–3499
The intermetallic μ-phase, which precipitates in steels and superalloys, can noticeably soften the mechanical properties of their matrix. Despite the importance of developing superalloys and steels, the thermodynamic properties and directions of thermal expansion of the μ-phase are still poorly studied. In this work, the thermal expansion paths, elastic, thermal and thermodynamic properties of the ...
Added: July 25, 2025
Dmitry Vasilyev, Gorev V., Physica B: Condensed Matter 2025 Vol. 699 Article 416850
Thermal expansion anisotropy, elastic, thermal and thermodynamic properties of C14 Fe2Nb Laves phase have been studied using first-principles based quasi-harmonic Debye - Grüneisen approximation. The search for thermal expansion was carried out by a new simplified method, which allows to reduce the problem to a one-dimensional case. The electronic, vibrational and magnetic subsystems were taken ...
Added: March 31, 2025
Dmitry Vasilyev, Renat S. Ikhsanov, Zheleznyi M. et al., Journal of Materials Science 2025 Vol. 60 P. 5427–5441
Compounds with structures of the Laves phase type, which are precipitated in the matrix of steels or superalloys as a result of the work of the product at high temperatures, are usually considered useful strengthening phases, whose elastic and thermal properties are of considerable interest. In our work, the coefficients of the elastic tensor of ...
Added: March 29, 2025
Kagan M., Silkin V. M., Efremov D. V., / Series arXiv "math". 2024. No. 2411.12836.
In this study, we analyze the dielectric function of high-Tc cuprates as a function of doping level, taking into account the full energy band dispersion within the CuO2 monolayer. In addition to the conventional two-dimensional (2D) gapless plasmon mode, our findings reveal the existence of three anomalous branches within the plasmon spectrum. Two of these branches ...
Added: November 27, 2024
Influence of anisotropy on the study of critical behavior of spin models by machine learning methods
Sukhoverkhova D., Shchur L., / Series arXiv "math". 2024. No. 2410.14523.
In this paper, we applied a deep neural network to study the issue of knowledge transferability between statistical mechanics models. The following computer experiment was conducted. A convolutional neural network was trained to solve the problem of binary classification of snapshots of the Ising model's spin configuration on a two-dimensional lattice. During testing, snapshots of ...
Added: October 21, 2024
Mozolenko V., Fadeeva Marina, Shchur L., / Series arXiv "math". 2024. No. 2405.10865.
The development of new algorithms for simulations in physics is as important as the development of new analytical methods. In this paper we present a comparison of the recently developed microcanonical population annealing (MCPA) algorithm with the rather mature Wang-Landau algorithm. The comparison is performed on two cases of the Potts model exhibiting a first ...
Added: May 20, 2024
Kagan M., Аксёнов С. В., / Series Research Square "Research Suqare". 2024. No. 1.
We study different resonances (first of all of the Fano type) in the interference device formed by the Aharonov-Bohm ring with superconducting (SC) wire in the topologically nontrivial state playing a role of a bridge between top and bottom arms. We analyze Majorana modes on the ends of the SC wire and show that the collapse of the ...
Added: April 10, 2024
Ребров Я. В., Glazkov V., Murtazoev A. F. et al., / Series cond-mat "arxiv.org". 2023.
Nabokoite family compounds ACu7(TeO4)(SO4)5Cl (A=Na, K, Cs, Rb) are one of the candidates for the evasive spin-liquid state predicted for highly-frustrated square kagome lattice (SKL). Their magnetic subsystem includes SKL layers decorated by additional copper ions. All members of this family are characterized by quite high Curie-Weiss temperatures (∼80−200 K), but magnetic ordering was reported ...
Added: January 29, 2024
Shurakov A., Kaurova N., Belikov I. et al., / Series Physics "arxiv.org". 2022.
In this paper, we report on the method of nondestructive quality control that can be used in fabrication of GaAs high-speed electronics. The method relies on the surface potential mapping and enables rigid in vivo analysis of transport properties of an active electronic device incorporated into a complex integrated circuit. The study is inspired by ...
Added: September 15, 2023
Pugach N., Safonchik M. O., Belotelov V. et al., / Series "cond-mat". 2022. No. 2110.00369.
A detailed investigation of a superconducting spin-triplet valve is presented. This spin-valve consists of a superconducting film covering a metal with an intrinsic spiral magnetic order, which could result from competing isotropic exchanges or, if the crystal lattice breaks central symmetry, from asymmetric Dzyaloshinskii-Moriya exchange. Depending on the anisotropy, such a metal may change its ...
Added: November 16, 2022
Novikov S. V., / Series cond-mat "arxiv.org". 2022. No. 2209.14955.
Charge transport in amorphous semiconductors having spatially correlated exponential density of states (DOS) has been considered for the arbitrary behavior of the correlation function of random energies. Average carrier velocity is exactly calculated for the quasi-equilibrium (nondispersive) transport regime. For the symmetric exponential DOS with exponential tails for low and high energies and non-positive correlation ...
Added: November 1, 2022
Ikhsanov R., Mazur E., Kagan M., / Series "Working papers by Cornell University". 2022. No. 2202.01452.
At present, the task of searching for compounds with a high superconducting transition temperature is a very relevant scientific direction. Usually, the calculation of is carried out by numerically solving the system of Eliashberg equations. In this paper, a set of programs for solving this system written in various forms on the imaginary axis is ...
Added: February 4, 2022
Budkov Y., Zavarzin S., Kolesnikov A. L., Journal of Physical Chemistry C 2021 Vol. 125 No. 38 P. 21151–21159
We formulate a general mean-field theory for a flat electric double layer in ionic liquids and electrolyte solutions with ions possessing static polarizability and a permanent dipole moment on a charged electrode. We establish a new analytical expression for electric double-layer differential capacitance, determining it as an absolute value of the ratio of the local ...
Added: September 16, 2021
Sanina N., Isaeva U., Utenyshev A. et al., Inorganica Chimica Acta 2021 Vol. 527 Article 120559
A new inhibitor of phosphodiesterase (PDE), i.e., nitric oxide (NO) donor, a water soluble DNIC Na[Fe(C7H5N4S)2(NO)2]⋅2.5H2O (1), has been synthesized. The structure of the new complex, its physical-chemical properties in the solid state and in solutions have been studied experimentally (X-ray analysis, IR, UV-Vis, Mossbauer spectroscopy, mass-spectrometry, and amperometry) and theoretically (quantum-chemical modeling by DFT ...
Added: September 16, 2021
Smirnov I. S., Novoselova E., Monakhov I. et al., В кн.: Тезисы докладов Всероссийского совещания по использованию рассеяния нейтронов и синхротронного излучения в конденсированных средах (РНСИ-КС-2014).: СПб.: ФГБУ "ПИЯФ" НИЦ "Курчатовский институт", 2014. С. 151–151.
The report considers the influence of the concentration of the alloying components with different atomic radius on the lattice parameter and the size of coherent scattering regions (CSR)of Fe-(Cr, V, Mo)alloys. ...
Added: March 11, 2015
Smirnov I. S., Monakhov I., Удовский А. Л. et al., Металлы 2013 Т. - № 1 С. 24–31
The modeling of the thermodynamic properties of alloys of the Fe-Cr at elevated temperatures has been performed. The concentration dependence of the Debye temperature, the lattice parameter, the elastic modulus, the average magnetic moment and the Curie temperature were determined. The studies were performed on samples of iron, alloyed with chromium and vanadium in the ...
Added: March 13, 2013