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Том 125, № 1 (2018)

Spectroscopy and Physics of Atoms and Molecules

Collisional Broadening of CO2 Transition Lines 1000–0001 by Inert Gas Atoms at 300–700 K

Arshinov K., Krapivnaya O., Nevdakh V., Syrtsov S., Shut V.

Аннотация

Using a tunable CO2 laser, unsaturated absorption coefficients in pure CO2 and binary CO2 gas mixtures with inert gases He, Ar, Kr, and Xe in a 1 : 2 ratio at 100 Torr were measured at the central frequencies of the R(8), R(22), P(8), P(22), and P(32) CO2 spectral lines of the 1000-0001 transition at 300–700 K. The coefficients of the collisional broadening of the CO2 spectral lines by He, Ar, Kr, and Xe are determined. The obtained temperature dependences of the collisional broadening coefficients are approximated by power functions with two different degrees.

Optics and Spectroscopy. 2018;125(1):1-4
pages 1-4 views

Raman Spectra of n-Butane, Isobutane, n-Pentane, and Isopentane in a Methane Environment

Petrov D., Matrosov I., Zaripov A.

Аннотация

We have studied the particular features of the Raman spectra of gaseous n-butane, isobutane, n-pentane, and isopentane in a methane medium at a pressure of 25 atm. It has been found that, under these conditions, changes in the conformational equilibria of these molecules are negligible, and most significant changes in the spectra are observed in the range of 2850–3000 cm–1, in which bands corresponding to the stretching vibrations of CH2 and CH3 groups shift to lower frequencies. The data obtained will be usefull in determining the composition of natural gas using Raman spectroscopy.

Optics and Spectroscopy. 2018;125(1):5-9
pages 5-9 views

Magnetic Resonance Frequency Shifts of Spin-Polarized Cesium Atoms in a Cs–Rb Mixture

Kartoshkin V.

Аннотация

The interaction of spin-polarized cesium atoms with cesium and rubidium atoms under conditions of optical orientation of atoms is considered. On the basis of data on spin-exchange complex cross sections in the Cs–Cs and Cs–Rb systems, a calculation of a magnetic resonance frequency shift of cesium atoms in a Cs–Rb mixture, as well as comparison of the calculated values of the frequency shift with experimental data, is performed.

Optics and Spectroscopy. 2018;125(1):10-13
pages 10-13 views

Structural, Spectroscopic, Antimicrobial Activity and DFT Studies on 4-Methyl-N-(4-methylphenylsulfonyl)-N-phenylbenzenesulfonamide

Eren B., Koçak F., Özdemir N.

Аннотация

This study reports the structural characterization of a disulfonimide derivative, 4-methyl-N-(4-methylphenylsulfonyl)-N-phenylbenzenesulfonamide (MPBSA), using spectroscopic and quantum chemical methods. The molecule was characterized with FT-IR, 1H 13C NMR and UV-Vis spectroscopies. Quantum chemical calculations of molecular geometry, vibrational wavenumbers and gauge including atomic orbital (GIAO) 1H and 13C-NMR chemical shifts of the compound were carried out by using density functional method (DFT) at B3LYP/6−311++G(d,p) level of theory. Electronic absorption spectra of the compound have been computed using the time-dependent density functional theory (TD-DFT) method at the same level. A satisfactory consistency between the experimental and theoretical findings was obtained. The antimicrobial activity screening of the compound was performed on some bacteria and fungus species using microdilution method. The results showed that the title molecule have noteworthy antibacterial and antifungal activities.

Optics and Spectroscopy. 2018;125(1):14-21
pages 14-21 views

Spectroscopy of Condensed States

Quasi-Elastic Light Scattering in Congruent Lithium Niobate Crystals

Anikiev A., Umarov M.

Аннотация

Raman scattering spectra in the frequency range of 5–75 cm–1 in lithium niobate samples with various structural imperfections were obtained. It is shown that the intensity of quasi-elastic light scattering on the wing of the Rayleigh line demonstrates an exponential dependence on the concentration of large-scale defects in the samples. Calibration curves for the intensity of quasi-elastic scattering dependence at low frequencies on the acoustic quality factor are constructed.

Optics and Spectroscopy. 2018;125(1):22-27
pages 22-27 views

Polarized Raman Scattering in Silicon Layers on Sapphire

Igo A.

Аннотация

The intensities of polarized components of Raman light scattering are measured for different crystallographic directions in epitaxial layers of silicon on sapphire. The experiment shows that the scattered radiation has a strong depolarized component, which is directly related to the occurrence of defects in the epitaxial layer. A model of an ensemble of crystallites is proposed to describe a defect crystal silicon layer on sapphire. It is shown that the characteristic value of disordering of crystalline domains in the epitaxial layer can be determined from the ratio between the intensities of the polarized and depolarized components. From measurements of the Raman scattering intensity as a function of the crystallographic direction, the anisotropy of the Raman scattering tensor is determined. Numerical values for two samples are obtained.

Optics and Spectroscopy. 2018;125(1):28-33
pages 28-33 views

Conformers and Electronic Spectra of Dansylamide: Experimental and Theoretical Studies

Fedorov M., Giricheva N., Lapykina E., Korableva M.

Аннотация

Particular features of the geometrical and electronic structure of six possible conformers of dansylamide ((CH3)2N–C10H6–SO2NH2) are considered. The electronic absorption spectra of the conformers of dansylamide in the free state and taking into account the influence of an aqueous solvent (in terms of the PCM model) are calculated by the TDDFT method. It is shown that, as a result of taking into account solvation, the electronic absorption spectra of the conformers exhibit a bathochromic shift, and the difference in the values of λ of the conformers reaches 16 nm. The calculated electronic absorption spectra in an aqueous medium agree qualitatively with the obtained experimental spectra. An analysis of molecular orbitals involved in the first three electronic transitions of the conformers is carried out. It is suggested that the broadening of the band with λmax = 326 nm in the experimental spectrum may be caused by the presence of dansylamide conformers in the aqueous solution. It is shown that the calculated values of λ in the electronic absorption spectra of dansylamide in the aqueous solvent depend substantially on the DFT functional type.

Optics and Spectroscopy. 2018;125(1):34-41
pages 34-41 views

Spectroscopy of a Cavitating Liquid in the Optical and X-ray Spectral Ranges

Belyaev I., Biryukov D., Gerasimov D.

Аннотация

Results of spectroscopic investigation of a multibubble sonoluminescence and a hydrodynamic luminescence of glycerol in the optical range between 400 and 700 nm and in the X-ray spectral interval between 1 and 70 keV are presented. Continuous spectrum the shape of which is sufficiently well described by the normal distribution with respect to photon energy was obtained for both sono- and hydroluminescence in the optical spectral range. Based on the identity of the spectra, a conclusion can be drawn that the effects of the sono- and hydroluminescence are of the same physical nature. The shape of the obtained spectra suggests that the observed glow of a liquid under mechanical action represents fluorescence of only one type of centers in a condensed medium. X-ray radiation is absent in the specified energy range. Although an X-ray spectrometer detects some a signal of some kind, in reality, this turns out to be noise created by the magnetostrictive transducer of an ultrasonic generator.

Optics and Spectroscopy. 2018;125(1):42-48
pages 42-48 views

Color and Luminescence Centers in LuAG and Pr:LuAG Crystals Before and After 60Co γ-Irradiation

Islamov A., Ibragimova E., Khaiitov I., Vil’danov R., Amonov M.

Аннотация

The absorption and thermoluminescence spectra and their relaxation in pure and praseodymium-doped LuAG crystals are comparatively studied to determine the contribution of intrinsic and impurity defects before and after irradiation by 60Co γ-quanta with an average energy of 1.25 MeV, dose rate of 0.8 Gy/s, and dose of 103 Gy at 310 K. The existence of intrinsic F+ defects with a typical absorption band at 375 nm and impurity Cr4+ centers absorbing at 285, 420, 490, and 595 nm in both LuAG and Pr:LuAG samples before irradiation is related to the crystal-growth technology and the impurity composition of the charge. An increase in the concentration of F+ and Cr4+ centers after γ-irradiation is caused by charging of neutral F centers and changing of the electronic state (valence) of Cr3+ impurity centers. Formation of antisite defect complexes LuAl3+–VO, which are responsible for a luminescence band at 335 nm, is suggested. The first broad peak at 340 K on the thermoluminescence curves of both samples after irradiation with a dose of 103 Gy is related to liberation of charge carriers from shallow trapping levels; thermal activation and radiative recombination with emitting centers begin at 310 K, which places the upper limit on the temperature range of application of these scintillation crystals.

Optics and Spectroscopy. 2018;125(1):49-53
pages 49-53 views

Physical Optics

Inscription and Visualization of Tilted Fiber Bragg Gratings

Konnov K., Frolov E., Gribaev A., Zakharov V., Mikhneva A., Novikova V., Varzhel S.

Аннотация

Tilted fiber Bragg gratings with different tilt angles have been inscribed in single-mode isotropic optical fiber with an increased photorefractivity using Talbot interferometer and KrF-excimer laser system. Their spectra are studied. Using a confocal laser scanning luminescent microscope the images of gratings in transmitted light were obtained. The calculated dependence of the slope angle of the grating recorded in the Talbot interferometer on the angle between the strokes of the interference pattern created in the interferometer and the transverse section of the optical fiber is experimentally verified.

Optics and Spectroscopy. 2018;125(1):54-59
pages 54-59 views

Spectral and Angular Dependences of the Efficiency of Three-Layer Relief-Phase Diffraction Elements of the IR Range

Greisukh G., Danilov V., Stepanov S., Antonov A., Usievich B.

Аннотация

Within the framework of the scalar and rigorous diffraction theory based on solving a system of Maxwell equations, saw-tooth relief-phase three-layer microstructures designed for the work with polychromatic radiation of the mid-IR range (3 ≤ λ ≤ 5 μm) are studied. The series of effective microstructures composed of different optical materials is extended, and the depths of their reliefs are minimized. The series is extended, in particular, owing to microstructures in which Fresnel losses for reflection from both reliefs do not exceed 10%. This factor, in combination with the relatively low total relief depth, can turn out to be decisive when choosing one or another microstructure for solving a specific scientific or technological problem.

Optics and Spectroscopy. 2018;125(1):60-64
pages 60-64 views

Holography

The Effect of Short-Wave UV Radiation in Recording Holographic Structures on Gelatin-Containing Recording Media (Overview)

Ganzherli N., Gulyaev S., Maurer I.

Аннотация

The review discusses the possibility of obtaining highly effective relief-phase structures on silver halide photographic emulsions and dichromated gelatin layers by irradiating initially recorded holographic structures with short-wave UV radiation.

Optics and Spectroscopy. 2018;125(1):65-73
pages 65-73 views

Nonlinear Optics

Sum-Frequency Generation from a Thin Spherical Layer: II. Analysis of Solution

Shamyna A., Kapshai V.

Аннотация

We have analyzed the influence of the angle between the wave vectors of two incident waves (the opening angle) and of the type of the anisotropy of a nonlinear layer on the shape of the directivity pattern of a sum-frequency harmonic generated by the two plane elliptically polarized electromagnetic waves from a thin spherical optically nonlinear layer deposited on the surface of a dielectric spherical particle placed in a dielectric. Our analysis has shown that, if the radius of the thin spherical nonlinear layer is small, the shape of the directivity pattern will change significantly with increasing opening angle only for some types of anisotropy: the main lobes shift toward the direction that is opposite to the direction of the sum of the wave vectors of the incident waves. For three types of anisotropy, the directivity patterns have similar shapes. We have also found that, for one of the types of the anisotropy, the shape of the directivity pattern remains unchanged upon a change in the opening angle. The mathematical properties of functions describing the spatial distribution of the generated harmonic have been determined. In particular, it has been found that, upon incidence of linearly polarized waves on a thin nonlinear spherical layer that possesses either solely chiral or solely nonchiral nonlinear properties, linearly polarized radiation of the sum-frequency harmonic is generated.

Optics and Spectroscopy. 2018;125(1):74-81
pages 74-81 views

Optical Materials

Monomers with a High Refraction Index Based on Acryloyl Derivatives of Spirocyclic Piperidin-4-One Thioacetals

Basistyi V., Bukhtoyarova A., Vasil’ev E., Shelkovnikov V.

Аннотация

Dithioazaspiroheterocyclic derivatives are synthesized by condensing dithiols with piperidin-4-one in the presence of catalytic amounts of Lewis acids. Acrylic dithioazaspiroheterocyclic derivatives are obtained by the reaction with acryloyl chloride. The polymerization of monomers yields transparent polymer films of optical quality. The refractive indices for the synthesized monomers and polymers are in the range of n = 1.59–1.64.

Optics and Spectroscopy. 2018;125(1):82-87
pages 82-87 views

Optics of Low-Dimensional Structures, Mesostructures, and Metamaterials

Comparative Features of Electromagnetic Scattering by an Invisible Spherically Symmetric Lens with a Negative Refractive Index

Smolnikova O., Skobelev S.

Аннотация

A spherically symmetric lens with a negative refractive index, which can be invisible from the point of view of geometrical optics, is considered. Expressions describing the profile of the refractive index and ray trajectories in the lens, as well as some results of numerical modeling of plane wave scattering by the lens in the rigorous statement of the problem, are presented. It is detected that, unlike in the case of an invisible lens with a positive refractive index, the minima of the radar cross section in the forward direction corresponding to invisibility for the lens with a negative index occur at integer, rather than semi-integer, values of the electric radius, and that their depth is smaller because of the astigmatism associated with focusing of rays on the axis. Some results characterizing influence of losses in the lens on the level of the radar cross-section minima are also presented.

Optics and Spectroscopy. 2018;125(1):88-93
pages 88-93 views

Nanophotonics

Water-Soluble Conjugates of ZnS:Mn Quantum Dots with Chlorin e6 for Photodynamic Therapy

Visheratina A., Loudon A., Kuznetsova V., Orlova A., Gun’ko Y., Baranov A., Fedorov A.

Аннотация

Water-soluble conjugates based on semiconductor quantum dots ZnS:Mn with chlorin e6 have been created. It has been established by optical spectroscopy that effective energy transfer (~35%) from quantum dots to chlorin e6 is observed in the resulting conjugates.

Optics and Spectroscopy. 2018;125(1):94-98
pages 94-98 views

Photocatalytic Properties of Hybrid Nanostructures Based on Nanoparticles of TiO2 and Semiconductor Quantum Dots

Kolesova E., Orlova A., Maslov V., Gun’ko Y., Cleary O., Baranov A., Fedorov A.

Аннотация

Multilayer hybrid nanostructures based on nanoparticles of TiO2 and CdSe/ZnS semiconductor quantum dots were formed. Generation of active forms of oxygen by hybrid nanostructures under visible-light irradiation is demonstrated to take place, which is indicative of efficient photoinduced electron transfer from quantum dots to titanium-oxide nanoparticles contained in the hybrid nanostructures.

Optics and Spectroscopy. 2018;125(1):99-103
pages 99-103 views

Nanosized Particles of Tantalum, Hafnium, and Cerium Oxides Used with Monochromatic Photon Beams and Brachytherapy Sources

Morozov V., Belousov A., Krusanov G., Kolyvanova M., Krivoshapkin P., Vinogradov V., Chernyaev A., Shtil A.

Аннотация

High-Z nanoparticles can increase the absorbed radiation dose if they are accumulated in tumor cells. The quantitative measure of this radiosensitization effect is the dose enhancement factor (DEF), that is, the ratio of the doses absorbed in the presence and in the absence of nanoparticles. In the present work, the values of the dose enhancement factors of Ta2O5, HfO2, and CeO2 ceramic nanoparticles were calculated analytically for monochromatic radiation of the X-ray energy range (1–180 keV) and for low-energy sources for brachytherapy: 103Pd (mean energy, 20.6 keV), 125I (26.7 keV), and 131Cs (30.4 keV). For all types of nanoparticles in the concentration of 5 mg/mL, the values of the dose enhancement factor were high both for monochromatic radiation and for brachytherapy sources. The highest DEF values of ~1.7 were obtained for nanoparticles of tantalum oxide. For brachytherapy sources, the highest dose enhancement factors (1.48 to 1.67) were obtained for Ta2O5 and HfO2 nanoparticles. These results confirm that ceramic nanoparticles are promising dose modifying agents for radiotherapy.

Optics and Spectroscopy. 2018;125(1):104-106
pages 104-106 views

Singlet-Oxygen Sensitization by Associates of Methylene Blue with Colloidal Ag2S Quantum Dots Passivated by Thioglycolic Acid

Ovchinnikov O., Smirnov M., Kondratenko T., Perepelitsa A., Grevtseva I., Aslanov S.

Аннотация

Luminescence studies of singlet-oxygen photosensitization by methylene blue molecules in various solvents, as well as by hybrid associates of this dye with colloidal Ag2S quantum dots with average sizes of 2.0, 2.4, and 2.7 nm, are performed. The conditions for simultaneous singlet-oxygen photosensitization and detection of the IR luminescence of colloidal Ag2S quantum dots passivated by thioglycolic acid are determined.

Optics and Spectroscopy. 2018;125(1):107-112
pages 107-112 views

Biophotonics

Correction of Fluorescent Images of Biological Tissues for the Effects of Light Absorption and Scattering

Lysenko S.

Аннотация

A method for correcting the influence of light attenuation processes in biological tissues on their fluorescent images is proposed. The transfer function that takes into account the radiation losses in the medium at the wavelengths of excitation and emission of fluorescence is calculated analytically, depending on the transport scattering index and the hemoglobin tissue index. The latter is determined on the basis of a color image of the tissue in reflected visible light. Verification of the developed method was carried out on the basis of computer simulation of fluorescent images of biological tissue by the Monte Carlo method.

Optics and Spectroscopy. 2018;125(1):113-122
pages 113-122 views

Photoinduced Breaking of the Fe–O2 Bond in Hemoglobin: Dissociation Quantum Yield, Excited Electronic States, and Nonradiative Relaxation Processes

Dzhagarov B., Lepeshkevich S., Panarin A., Parkhats M., Chaikovskii A.

Аннотация

Bimolecular recombination of molecular oxygen with human hemoglobin upon excitation in different spectral ranges is studied by nanosecond laser kinetic spectroscopy. The results obtained are fundamentally different; i.e., rather efficient photodissociation takes place in the case of excitation into the Q-band of the ππ* nature and is practically absent upon excitation into the near-IR band corresponding to the electron transfer from the porphyrin a2u orbital to a mixed orbital formed of the iron d orbital and the free π orbital of molecular oxygen. Analysis of these data, together with data obtained previously using the techniques of nano-, pico-, and femtosecond spectroscopy, allowed us to describe the mechanism and dynamics of the photodissociation reaction and intraheme relaxation processes.

Optics and Spectroscopy. 2018;125(1):123-129
pages 123-129 views

Applied Optics

Application of Laser Induced Breakdown in Air in Conjunction with Atomic Absorption Spectroscopy for Detection of Trace Elements in Fennel Seeds

Rehan I., Sultana S., Rehan K., Muhammad R., Mateen A., Farooque M.

Аннотация

A robust approach of laser-induced breakdown spectroscopy (LIBS) in ambient air has been employed to investigate concentration of the trace elements in fennel seeds (saunf) via generation of plasma through the second harmonic of solid state Nd: YAG pulsed laser 532 nm. Spectral emissions of saunf plasma were acquired with resolution of 0.06 nm in spectral range of 200–720 nm. The experimental determination showed the existence of elements namely, Ca, Al, K, Fe, S, P, Mg, Mn, Sr, Na, and Zn in the sample. However, no toxic elements such as Pb, Cr etc. were perceived. The relative concentrations of detected elements were measured through the intensity of the strongest peak, intensities of every emission from every specie, and calibration free (CF)-LIBS. To indorse the experimental determinations of LIBS, a comparative study was carried out with the outcomes of atomic absorption spectroscopy (AAS). The results of LIBS and AAS were compared by the statistical treatment.

Optics and Spectroscopy. 2018;125(1):130-136
pages 130-136 views

Features of Construction of the Fluorescent Microscope for the Study of Epithelial-Mesenchymal Transition of Cells in Vitro

Fomicheva K., Kindeeva O., Petrov V., Ivanov A., Poloznikov A., Alekseev B., Shkurnikov M.

Аннотация

An optical luminescent microscope has been developed to monitor the behavior of tumor cells that were modified by GFP and RFP fluorescent proteins and to monitor the formation of metastases in biochips. Images of cells in the light of GFP and RFP fluorescence proteins, as well as in the photography mode, are recorded in the microscope by an noncooled CMOS matrix at the excitation of luminescence by blue and green LEDs and illumination of cells with white LEDs, respectively. The obtained fluorescent images and photos in white light are recorded by the matrix in the same coordinate system and do not require additional processing for combination. The power of irradiation of cells with LEDs does not exceed 50 μW/mm2 at an exposure time of 1 s, which is an order of magnitude lower than the radiation power causing photodestruction and phototoxicity of cells during long-term studies. Relative parameters of the optical channel of the luminescent microscope have been introduced that allow comparing the sensitivity of the recording system and the minimum power level of the radiation that excites luminescence for optical elements with different spectral characteristics.

Optics and Spectroscopy. 2018;125(1):137-143
pages 137-143 views

Photoluminescence Spectra in Polycrystals of Chirally Pure and Racemic Phases of Tryptophan

Gorelik V., Umarov M.

Аннотация

The photoluminescence spectra of three crystalline phase modifications of aromatic amino acid tryptophan are compared: the left phase of L-tryptophan, the right phase of D-tryptophan, and the racemic phase of DL-tryptophan. The photoluminescence spectra were recorded using a fiber-optic procedure, a small-size FSD-8 spectrometer, and a data processing system that enables comparison of the analyzed spectrum with the spectrum of a reference substance. Photoluminescence was excited by a pulsed-periodic ultraviolet laser at a wavelength of 266 nm.

Optics and Spectroscopy. 2018;125(1):144-147
pages 144-147 views

Single-Photon Counting in Luminescent Analysis with Micro- and Millisecond Decay Times

Onishchuk D., Parfenov P.

Аннотация

Main methods of photon counting, as well as particularities in detecting micro- and millisecond decay times using a single-photon gated avalanche photodiode, are considered. The influence of the background radiation level on linearity of counting has been determined and the effect of photon superposition during asynchronous counting has been demonstrated. In addition, recommendations for the detection of long-living or delayed fluorescence and phosphorescence are presented.

Optics and Spectroscopy. 2018;125(1):148-151
pages 148-151 views