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Компьютерное конструирование соединений с кристаллической структурой мелилита
Материаловедение. 2019. № 9. С. 41–48.
Киселева Н. Н., Dudarev V., Рязанов В. В., Сенько О. В., Докукин А. А.
Toukach P., Smirnova N. S., Zdorovenko E. L. et al., Analytical Chemistry 2026 Vol. 98 No. 15 P. 10988–10996
Pyruvylation is one of the immunochemically relevant modifications of O-antigens in bacterial and fungal cells. Therefore, fast and relatively simple analytical methods for identifying this modification are highly demanded. 13C NMR spectroscopy is the best candidate for this purpose, but its successful application requires using reference structures and reliable databases. In this work, we collected ...
Added: May 25, 2026
Андреев Д. В., Корнев С. А., Bondarenko G. et al., Перспективные материалы 2026 № 6 С. 5–11
Выполнено сравнительное исследование процессов сильнополевой зарядовой
деградации подзатворного диэлектрика структур металл-диэлектрик-полупроводник (МДП)
с алюминиевым и поликремниевым затвором. Зарядовые явления в МДП-структурах
изучали методом сильнополевой инжекции электронов в диэлектрик в режиме возрастания
плотности стрессового инжекционного тока с кратковременными переключениями
в измерительный режим при постоянной низкой плотности инжекционного тока.
Использование данного метода позволило получить новые данные о процессах зарядовой
деградации подзатворного диэлектрика МДП-структур с ...
Added: May 21, 2026
Bezzubov S., Malikov D., Krasnov L. et al., Scientific data 2026 Vol. 13 Article 727
Solubility is a crucial property of organic compounds, impacting their potential applications in synthetic chemistry, materials science and drug design. Moreover, in technological processes mixtures of solvents are often utilized, making the solubility assessment more complicated. Predicting solubility values in mixtures of solvents from a molecular structure can help to address this issue, although a ...
Added: May 19, 2026
Rathish S., Andrey S. Vasenko, Thazhathenair A. et al., The Journal of Physical Chemistry Letters 2026 Vol. 17 No. 18 P. 5386–5394
We demonstrate and rationalize the effect of Au nanoparticles (NPs) on the hierarchical g-C3N4/CeO2 heterojunction. g-C3N4/CeO2 decorated with monodispersed plasmonic Au NPs was synthesized. Detailed analyses showed that CeO2 nanocubes and monodispersed Au NPs were evenly distributed over the 2D g-C3N4 surface, forming a robust interface enriched with abundant active sites. The structure enabled efficient separation of photogenerated charge ...
Added: May 16, 2026
Das A., Paul R., Sharma N. et al., Colloids and Surfaces A: Physicochemical and Engineering Aspects 2026 Vol. 728 P. 138830
Niobium-doped TiO2 (Nb-TiO2), demonstrates dual functionality as an efficient photocatalyst for dye degradation and a promising photoelectrocatalyst for water oxidation. Nb incorporation via a facile hydrothermal method was confirmed by XRD (Rietveld refinement), XPS, TEM, FT-IR, Raman, and BET analyses, indicating successful lattice doping and structural modification. Photocatalytic dye degradation experiments were conducted using a model ...
Added: May 16, 2026
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
Гущина В. А., Mendeleev Communications 2025 Vol. 35 No. 2 P. 193–195
All-inorganic perovskite CsPbBr3 and Cs4PbBr6 nanoparticles are intensively studied for their unique optical properties, though synthesizing single-phase nanoparticles has posed challenges. Detailed synthesis method of CsPbBr3 and Cs4PbBr6 single-phase nanoparticles and their chemical and phase analysis are described. Distinctive optical characteristics, such as photoluminescence, optical band gap and the Urbach tail region, are revealed and explained within the current ...
Added: May 14, 2026
Гущина В. А., Physics of Complex System 2026 Vol. 7 No. 1 P. 3–15
Heterostructures based on ZnO nanorods and CsPbBr3 nanocrystals were investigated for their potential as semiconductor SERS substrates. We found that ZnO morphology governs the efficiency of interfacial energy transfer, leading to enhanced photoluminescence under 390 nm excitation and a noticeable reduction of the bandgap in the composites. Raman analysis revealed a pronounced intensity enhancement and ...
Added: May 14, 2026
Гущина В. А., Russian Journal of Inorganic Chemistry 2024 Vol. 69 No. 6 P. 940–948
Currently, ABX3 nanoparticles (NPs) based on lead halides attract the attention due to their unique optical properties and a wide range of applications. The preparation of NPs with lead as a partial or complete replacement is particularly interesting because of the toxicity of this chemical element and most of its compounds. In this study, we propose a ...
Added: May 6, 2026
Yasnitsky L., Голдобин М. А., Мезенцев А. С., Прикладная математика и вопросы управления 2025 № 2 С. 99–116
Представлен обзор современных методов и основанных на них программных
инструментах, применяемых для математического моделирования серийных производственных процессов с целью снижения брака и повышения качества производимых изделий. Перечисляются группы работ, нацеленных на обнаружение и классификацию дефектов, работ, в которых решаются задачи прогнозирования образования дефектов и определения значимости параметров, работ направленных на поиск
оптимального сочетания технологических параметров изготовления изделий, ...
Added: May 5, 2026
Morozov E. V., Demin A. S., Borovitskaya I. V. et al., Inorganic Materials: Applied Research 2026 Vol. 17 No. 3 P. 619–626
This article presents the results of experiments on the impact of powerful pulsed ion-plasma and
electron flows generated in the working chamber of the Plasma Focus PF-5M installation during each highvoltage
discharge on a model aluminum alloy B95. It is shown that the general characteristics of the alloy’s
damage upon exposure to pulsed flows of helium ions (HI) ...
Added: May 4, 2026
Derkacheva A., Sakirkina M., Kraev G. et al., /. 2026.
Comprehensive data on natural hazards and their consequences are crucial for effective for risk assessment, adaptation planning, and emergency response. However, many countries face challenges with fragmented, inconsistent, and inaccessible data, particularly regarding local-scale events. To address this data gap in Russia, we developed an end-to-end processing pipeline that scrapes news from various online sources, ...
Added: April 28, 2026
Pavlenko V. I., Bondarenko G.G., Cherkashina N. I. et al., Inorganic Materials: Applied Research 2026 Vol. 17 No. 2 P. 276–282
A composite material based on polyethylene, boron carbide (B4C), and bismuth oxide (Bi2O3) is
synthesized by the method of joint cryogenic milling of all components in liquid nitrogen environment followed
by pressing. The effect of cryogenic milling on the distribution of fillers in a composite is studied and
the prospects of using this method are assessed in comparison ...
Added: April 9, 2026
Черкашина Н. И., Павленко В. И., Bondarenko G. et al., Перспективные материалы 2026 № 4 С. 14–26
В данной работе представлен синтез гибкого полимерного композита для защиты от радиации на основе каучуковой матрицы и оксидов редкоземельных металлов, таких как Dy2O3 и Gd2O3, предназначенного для создания радиационно-защитных экранов и средств индивидуальной защиты. Исследованы его физико-механические характеристики: составы с добавлением оксида диспрозия имеют плотность от 1,31 до 2,44 г/см3, предел прочности при растяжении от ...
Added: April 2, 2026
Chowde Gowda C., Alexey Kartsev, Tiwari N. et al., Journal of Materials Chemistry C 2024 Vol. 12 No. 46 P. 18691–18703
Two-dimensional (2D) chromium telluride Cr2Te3 exhibits strong ferromagnetic ordering with high coercivity at low temperatures and paramagnetic behavior when approaching room temperature. The spin states of monolayer Cr2Te3 show ferromagnetic ordering in the ground state. In situ Raman analysis reveals a reversible structure transformation and hence proves ferromagnetic to paramagnetic transition during low-temperature heating cycles (0–25 °C). The magnetic ...
Added: March 16, 2026
Argunov E., Alexey I. Kartsev, Computational Materials Science 2024 Vol. 244 Article 113192
Magnetothermopower and giant magnetoresistance in spinel-type compound has attracted a lot of attention recently. Ab initio computations of the electronic structure and the Seebeck coefficient of the structure are reported. The mixed nature of magnetism was identified to be caused by the competition between ferromagnetic and anti-ferromagnetic impacts, with the corresponding determined exchanged parameters: meV, meV, meV. Seebeck coefficient and electrical conductivity of the compound in the temperature range of K along with its ...
Added: March 16, 2026
Alshanskaia E., Martynova O., Portnova G. et al., Mendeley 2024
Eyetracking and vegetatics data in a cognitive load task
Published: 10 July 2024| Version 1
Description
Raw eyetracking and vegetatics data in a cognitive load task with additional false feedback in the second block. ...
Added: March 6, 2026
Xiao Y., Xue W., Xu N. et al., Rare Metals 2025 Vol. 44 No. 11 P. 8757–8768
Complete collection of target fluids and effective capture of biomolecules are essential when designing and fabricating sensor electrodes. Assembling a conductive metal–organic framework (MOF) film onto a high-surface-area porous aerogel to create a three-dimensional (3D) hierarchically ordered structure represented an effective strategy for fabricating sensor electrodes for body fluid detection. In this study, high-precision, confined ...
Added: March 2, 2026
Zhavoronok E. S., Lenkova K. A., Matrenina A. V. et al., Protection of Metals and Physical Chemistry of Surfaces 2025 Vol. 61 No. 5 P. 1231–1238
This study investigated two groups of surgical suture materials—nonabsorbable (polyethylene terephthalate,
polyamide, and silk) and absorbable (glycolic/lactic acid copolymer)—before and after accelerated aging. The analysis employed tensile strength testing, Fourier-transform infrared (FTIR) spectroscopy, and differential scanning calorimetry (DSC). Following domestic and international standards for polymer aging, the samples were subjected to the following initial accelerated aging ...
Added: February 19, 2026
Mehrabi-Kalajahi S., Vasigh S. A., Yousefi Bavili H. et al., Materials Advances 2026 Vol. 7 No. 2 P. 1127–1137
A series of monometallic catalysts, such as Fe3O4, CoO, NiO, and CuO, along with their entropy-stabilized nanoparticles [(Fe,Co,Ni,Cu)3O4 medium-entropy oxide (MEO)], were synthesized and subsequently utilized for the solvent-free and selective aerobic oxidation of benzyl alcohol when supported on graphene oxide (GO). The resulting nanocomposites underwent characterization through various techniques including X-ray diffraction (XRD), scanning electron ...
Added: February 18, 2026
Samoilova O., Pratskova S., Plotnikova P. et al., Materials Letters 2026 Vol. 403 Article 139506
Herein, the positive effect of Pt doping on the high-temperature oxidation of AlCoCrNiPt0.1 multi-principal element alloy (MPEA) is demonstrated. It is shown that platinum is not separated as a secondary phase; rather, it is dissolved in the solid solution phase. The studied alloy exhibited good resistance to high-temperature oxidation during a 100-hour isothermal holding at ...
Added: February 18, 2026
Maria Marakueva, Popova P., Data in Brief 2026 Vol. 65 Article 112508
Our objective is to create the most comprehensive database of Russian firms with the highest data frequency. We created the unique comprehensive database of quarterly financial statements for Russian firms, covering the period from 2014 to 2024. The dataset is assembled from Federal Tax Service of Russia (FNS), SPARK Interfax, Cbonds, and the Moscow Exchange. ...
Added: January 30, 2026
Sorokin P. S., Novikova V., Goshin M. E., Frontiers in Psychology 2025 Vol. 16 Article 1716164
Agency is a multidisciplinary concept denoting individual ability to initiate and carry out actions that transform one’s own life and social environment. Traditionally, in psychology, agency is viewed as an internal characteristic—a constellation of motives, attitudes, and cognitive schemas that drive human action. Studies of this sort focus on the desire to be active, the ...
Added: December 11, 2025
Rakhilina E. V., Гюласарян С. М., Бычкова П., Слово.ру: балтийский акцент 2025 Т. 16 № 2 С. 28–52
This study focuses on the Routinicon database as a digital tool for describing routines — a distinct class of formulaic phraseological units that represent reactions to or comments on standard extralinguistic situations. For instance, the formula Kogo ya vizhu! (Whom do I see!) serves as a reaction to an unexpected meeting, while Kto tam? (Who’s ...
Added: October 29, 2025