arXiv subjects

Marat Gafurov

Publications and source records attributed to Marat Gafurov.

6 recordsLinked to original sources

arXiv2026

High-Field EPR/ENDOR of N/Be Centers for Defect Engineering in 6H-SiC

Silicon carbide (SiC) in its various structural modifications is widely used in power semiconductor electronics, operating under extreme conditions of high temperature, high voltage, and intense radiation. The discovery of spin defects (S>0) with unique optical and coherent properties has further positioned SiC as a promising platform for quantum technologies. Here, we investigate a 6H-SiC single crystal co-doped with nitrogen and beryllium at concentrations of 1018 cm-3, using continuous-wave and pulsed electron paramagnetic resonance (EPR) and electron-nuclear double resonance (ENDOR). To enhance spectral resolution, experiments were conducted in the W-band (94 GHz; B = 3.4 T). Pulsed EPR identified nitrogen donors and beryllium acceptors in various lattice positions, allowing for the determination of their phase coherence and spin-lattice relaxation times. ENDOR measurements elucidated the electron-nuclear interactions with the local silicon and carbon environment, including distant coordination spheres. The observed hyperfine structures indicated highly delocalized spin density within the supercell. The TRIPLE resonance spectra verify coupled nuclear spin subspaces from different coordination spheres due to defect spin density. These results demonstrate the feasibility of incorporating dual impurities with distinct functional roles while preserving the crystal lattice`s structural features.

cond-mat.mtrl-sci↗

arXiv2019

Probing the surface of synthetic opals with the vanadyl-containing crude oil by using EPR and ENDOR techniques

Porous silica materials offer wide range of possibilities for enhancement of the productivity of oil reservoirs. However the mechanism of adsorption of polar components of crude oil on silica surface is poorly understood that hinders technological improvement of supports and oil extraction. We have synthesized opal films with the silica microspheres size of about 360 nm, specific surface area of 5.2 m2/g and pore size of 230 nm. We have fractionated and characterized oil and oil asphaltenes from heavy (Ashalchinskoe) oil. By pulsed electron paramagnetic resonance (EPR) and double electron nuclear resonance (ENDOR) in the W band frequency range (microwave frequency of 94 GHz, magnetic field of 3.4 T) we have studied the adsorption of oil asphaltenes on the surface of opal samples using the intrinsic for asphaltenes paramagnetic vanadylporphyrins (VO) complexes. 1H ENDOR spectra are found to be different for initial and the adsorbed samples in their central parts (that is a sign of asphaltenes VO disaggregation) whereas no significant changes in the W band EPR spectra were detected. Contrasting to alumina support, no strong electron proton interaction with the protons on the surface of SiO2 (presumably, silanol groups) was found and infiltration of the oiled opal films with gasoline changes the central part of 1H ENDOR spectra. It shows that the proton containing groups on the surface of amorphous SiO2 sample can significantly change the asphaltene adsorption properties and ENDOR of the intrinsic for oil paramagnetic centers could be used for the characterization of surface state in porous media in situ or operando.

physics.app-ph↗

arXiv2018

E' paramagnetic centers in nanoporous synthetic opals - a probe for near surface protons

The studies of chemical processes in spatially confined conditions are of interest from the fundamental and industrial points of view. By means of the W band EPR and 1H Mims electron nuclear double resonance (ENDOR) we show that the radiation-induced paramagnetic centers (E') in the synthetic nanoporous silica opals could be used as sensitive probes to investigate the surface modification and, potentially, reactions of polymerization in the confined by opal pores.

cond-mat.mes-hall↗

arXiv2017

In-situ identification of various structural features of vanadyl porphyrins in crude oil by high-field (3.4 T) ENDOR spectroscopy combined with DFT calculations

Structural characterization of metalloporphyrins in complex systems such as native hydrocarbons is in the focus of scientific and industrial interests since many years. We describe electron-nuclear double resonance (ENDOR) of crude oil from the well without any additional sample treatment (i.e., in the native environment) in the magnetic field of about 3.4 T and temperature of 50 K by applying microwave pulses at 94 GHz (W-band) and radiofrequency pulses at near the proton Larmor frequencies of 144 MHz to probe the paramagnetic vanadyls. By means of density functional theory (DFT) calculations, ENDOR features are explained and ascribed to certain vanadyl porhyrin structural forms known to be present in crude oil.

cond-mat.mtrl-sci↗

arXiv2015

Phonon Spectrum in Hydroxyapatite: Calculations and EPR Study at Low Temperatures

Density functional theory based calculations within the framework of the plane-wave pseudopotential approach are carried out to define the phonon spectrum of hydroxyapatite Ca10(PO4)6(OH)2 (HAp). It allows to describe the temperature dependence of the electronic spin-lattice relaxation time T1e of the radiation-induced stable radical NO32- in HAp, which was measured in X-band (9 GHz, magnetic field strength of 0.34 T) in the temperature range T = (10-300) K. It is shown that the temperature behavior of T1e at T > 20 K can be fitted via two phonon Raman type processes with the Debye temperature of 280 K evaluated from the phonon spectrum.

cond-mat.mtrl-sci↗

arXiv2014

Nitrogen-Containing Species in the Structure of the Synthesized Hydroxyapatite

Synthesized by the wet chemical precipitation technique hydroxyapatite powders (HAp) with the sizes of the crystallites of (20-50) nm and 1000 nm were analyzed by different analytical methods. By means of electron paramagnetic resonance (EPR) it is shown that during the synthesis process nitrate anions from the reagents (by-products) could incorporate into the HAp structure. The concentration of the stable NO32- radicals detected after X-ray irradiation of the product at room temperature does not decrease even after annealing up to 400 oC. The relaxation times and EPR parameters of the axially symmetric NO32- paramagnetic centers are measured with high accuracy. Increased sensitivity and resolution of high-frequency EPR (95 GHz) allows to reveal additional paramagnetic centre(s) which origin is discussed. Analyses of electron-nuclear double resonance (ENDOR) spectra from 1H and 31P nuclei and ab-initio density functional theory (DFT) calculations allow suggesting that the paramagnetic centers and nitrate anions as the precursors of NO32- radicals preferably occupy PO43- site in the HAp structure.

cond-mat.mtrl-sci↗