Search Results - "Bugaev, A. L"
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Revisiting the Extended X‑ray Absorption Fine Structure Fitting Procedure through a Machine Learning-Based Approach
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19-08-2021)“…A novel approach for the analysis of extended X-ray absorption fine structure (EXAFS) spectra is developed exploiting an inverse machine learning-based…”
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Evolution of the active species of homogeneous Ru hydrodeoxygenation catalysts in ionic liquids
Published in Chemical science (Cambridge) (14-09-2022)“…This work establishes structure-property relationships in Ru-based catalytic systems for selective hydrodeoxygenation of ketones to alkenes by combining…”
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Insight from X‑ray Absorption Spectroscopy to Octahedral/Tetrahedral Site Distribution in Sm-Doped Iron Oxide Magnetic Nanoparticles
Published in Journal of physical chemistry. C (19-04-2018)“…A set of Sm-doped iron oxide magnetic nanoparticles (Fe x O y NPs) of different sizes as an example of ferromagnetic NPs at room temperature was synthesized by…”
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In Situ Generated Dispersed Catalysts Based on Molybdenum and Tungsten Phosphides in Hydroprocessing of Guaiacol
Published in Petroleum chemistry (01-11-2022)“…Amorphous catalysts based on molybdenum and tungsten phosphides were prepared in situ from oil-soluble precursors such as triphenylphosphine and carbonyls of…”
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Transformations of Carbon Dioxide under Homogeneous Catalysis Conditions (A Review)
Published in Petroleum chemistry (2022)“…In view of the growing environmental concerns and the need to involve alternative sources of raw materials in the chemical industry, intensive research efforts…”
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An Effect of Internal Structure of Bimetallic Nanoparticles on Optical Properties for AuAg/Glass Material
Published in Physics of the solid state (01-12-2018)“…Optical extinction spectra calculated via multisphere T -matrices for nanoparticles with different concentrations of metals and different architectures…”
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Gd3+-Doped Magnetic Nanoparticles for Biomedical Applications
Published in Journal of spectroscopy (Hindawi) (01-01-2018)“…Magnetic nanoparticles (MNPs) made of iron oxides with cubic symmetry (Fe3O4, γ-Fe2O3) are demanded objects for multipurpose in biomedical applications as…”
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Pd hydride and carbide studied by means of Pd K-edge X-ray absorption near-edge structure analysis
Published in Bulletin of the Russian Academy of Sciences. Physics (01-09-2015)“…A Pd K -edge X-ray absorption near edge structure (XANES) analysis for palladium hydride and carbide nanoparticles is presented. It is shown that the presence…”
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Nickel nanoparticles in carbon structures prepared by solid-phase pyrolysis of nickel-phthalocyanine
Published in Journal of nanoparticle research : an interdisciplinary forum for nanoscale science and technology (01-07-2012)“…By using a modified method of solid-phase pyrolysis of metal-phthalocyanines, we have synthesized ferromagnetic Ni nanoparticles in different carbon…”
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Speciation of Ru Molecular Complexes in a Homogeneous Catalytic System: Fingerprint XANES Analysis Guided by Machine Learning
Published in Journal of physical chemistry. C (23-12-2021)“…X-ray absorption spectroscopy is a powerful tool for the characterization of local atomic structure. Commonly, bond lengths and coordination numbers are…”
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Phosphorus-free nitrogen-containing catalytic systems for hydroformylation and tandem hydroformylation-based reactions
Published in Applied catalysis. A, General (25-10-2022)“…Hydroformylation is an important industrial process applied for the production of many highly-demanded chemicals. For now, only the Co/phosphine, Rh/phosphine,…”
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12
Pd hydride and carbide studied by means of Pd K-edge X-ray absorption near-edge structure analysis
Published in Bulletin of the Russian Academy of Sciences. Physics (01-09-2015)Get full text
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13
Optical Properties of Materials for Magnesium Plasmonics Described within DFT+U Approach
Published in Optics and spectroscopy (2024)“…The most widely used and applied plasmonic materials, namely silver and gold, has limitations due to their high cost and restriction on the spectral position…”
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Effect of the Hydride and Carbide Phases of Palladium Nanoparticles on the Vibration Frequencies of Adsorbed Surface Molecules
Published in Kinetics and catalysis (01-04-2023)“…Palladium-based materials, including nanoparticles, are widely used in the petrochemical, pharmaceutical, automotive, and other industries. The hydride,…”
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Machine Learning for Determining the Architecture of Ensembles of Bimetallic PtCu Nanoparticles Based on Atomic Radial Distribution Functions
Published in Nanotechnologies in Russia (01-04-2024)“…It is known that the catalytic properties of materials based on bimetallic PtCu nanoparticles depend on both the composition and the distribution of atoms in…”
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Kinetics of the Atomic Structure of Palladium Nanoparticles during the Desorption of Hydrogen According to X-Ray Diffraction
Published in JETP letters (01-05-2019)“…The process of desorption of hydrogen from small palladium nanoparticles is monitored by time-resolved synchrotron X-ray diffraction. Changes in the…”
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Local Electric Field Enhancement in the Vicinity of Ag Nanoparticles and Their Agglomerates in Zinc-Phosphate and Silicate Glass
Published in Glass and ceramics (24-05-2024)“…Based on calculations, the spatial distribution of the local electric field (LEF) for various structural configurations of silver nanoparticles (NPs) in…”
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Compact Representation of the Local Atomic Structure of Matter for Machine Learning in XANES-Spectroscopy Data Processing
Published in Surface investigation, x-ray, synchrotron and neutron techniques (01-04-2024)“…The paper introduces a method for representing data on the local atomic structure as histograms of pair radial distribution functions categorized by atom…”
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Stereoselectivity of Acetylene Hydrochlorination over Supported PdCl2/С Catalysts
Published in Kinetics and catalysis (01-06-2023)“…Products of the catalytic hydrochlorination of deuterated acetylene over palladium chloride complexes supported on activated carbon are a mixture of vinyl…”
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Local Mid-Range Order in La2O3–Nb2O5–BsO3 and BaO–Nb2O5–P2O5 Glasses According to Full X-Ray Scattering Data
Published in Glass and ceramics (01-07-2023)“…Curves of full x-ray scattering at wavelength 0.20735 Å were measured and the corresponding radial distribution functions (RDFs) of the electron density for…”
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