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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Mikhaleva N. S., Visotin M. A., Popov Z. I., Kuzubov A. A., Fedorov A. S.
Заглавие : Ab initio and empirical modeling of lithium atoms penetration into silicon
Место публикации : Comput. Mater. Sci.: Elsevier, 2015. - Vol. 109. - P.76-83. - ISSN 0927-0256, DOI 10.1016/j.commatsci.2015.06.024
Примечания : Cited References: 69. - The authors would like to thank the Institute of Computational Modeling SB RAS, Krasnoyarsk, Information Technology Centre Novosibirsk State University, for providing access to their computational resources. The reported study was supported by RFBR, research project No. 14-02-31071, 14-02-31309, 12-02-00640, by the Council of the President of the Russian Federation for Support of Young Scientists and Leading Scientific Schools (project No. NSh-2886.2014.2), Increase Competitiveness Program of NUST "MISiS" (No. K2-2015-033). The authors also would like to thank Prof. Stephan Irle and L.R. Moskvina for fruitful discussions and helpful ideas.
Предметные рубрики: LONG CYCLE LIFE
CORE-LEVEL SPECTROSCOPY
CARBON-COATED SILICON
AUGMENTED-WAVE METHOD
ION BATTERIES
MOLECULAR-DYNAMICS
INTERATOMIC POTENTIALS
ELECTRONIC-STRUCTURE
CRYSTALLINE SILICON
SI(100)2X1 SURFACE
Ключевые слова (''Своб.индексиров.''): li-ion batteries--silicon--surface diffusion--li diffusion--density functional theory--molecular dynamics
Аннотация: A process of lithium atoms penetration into silicon (1 0 0) subsurface layers was investigated with the help of DFT method. It was shown that, while the concentration of lithium adatoms on reconstructed (1 0 0) silicon surface is low, the bonding energy of lithium atoms in the subsurface layers is smaller than the bonding energy on the surface, so lithium atoms are unlikely to migrate into the crystal. When the (1 0 0) silicon surface is covered by 2 layers of lithium, migration into the subsurface layer becomes favorable. In addition to this, the reconstruction of the surface changes to the form with symmetric dimers as the concentration increases. Thus, all possible lithium migration paths become energy-wise equal, so the rate of lithium atom transfer into silicon crystal rises. In addition to the ab initio calculations, an ad-hoc empirical interatomic potential was developed and the kinetics of lithium diffusion into silicon were studied. It was shown that lithium penetration proceeds in a layer-by-layer way with a sharp border between undoped and lithiated silicon. This is accounted for the fact that, once a tetrahedral interstice is occupied by a lithium atom, the migration barriers between the adjacent interstices become lower and the rate of diffusion increases. © 2015 Elsevier B.V. All rights reserved.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrov K. S., Burkov S. I., Samkov A. V., Kholov A., Khafizov S.Kh., Shabanova L. A., Klevtsov P. V.
Заглавие : Acoustooptic and elastic properties of NaBi(WO4)2 and LiBi(MoO4)2crystals
Коллективы : Красноярский государственный университет
Место публикации : Russ. Ultrason./ изд. орг. . - 1988. - Vol. 18, Is. 3. - P.168-171. - ISSN 0048-8828
Ключевые слова (''Своб.индексиров.''): acoustooptical devices--materials--elasticity--lithium compounds--sodium compounds--acoustooptic properties--bulk acoustic waves--elastic properties--crystals
Аннотация: In recent years interest has been shown in crystals with the scheelite structure (point symmetry group 4/m) as promising materials for acoustooptic devices. However, nearly all the work done so far has been on the NaBi(MoO4)2 and PbMoO4 crystals. In this paper the authors give the results of a study of the elastic and acoustooptic properties of NaBi(WO4)2 and LiBi(MoO4)2 crystals from a series of isomorphic compounds with the scheelite structure carried out in order to determine the extent of the changes in the elastic and acoustooptic properties of this series of crystals when the structural elements are changed.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrov K. S., Ivanov Y. N., Schafer A. D.
Заглавие : Spectroscopic investigation of phase transitions in CsLiMoO//4 crystals.
Коллективы : European Meeting on Ferroelectricity
Место публикации : European Meeting on Ferroelectricity (5 ; 1983 ; Sept. ; 26-30 ; Malaga, Sp). Ferroelectrics. - 1983. - Vol. 55, Is. 1. - P.671-674. - ISSN 0015-0193
Ключевые слова (''Своб.индексиров.''): crystals - structure--magnetic resonance--spectroscopy, raman--cesium lithium molybdate--phase transitions--ferroelectric materials
Аннотация: Raman and NMR spectra in cubic and two distorted phases of CsLiMoO//4 have been studied. Phase transitions in the crystal are shown to belong to order-disorder type.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrov K. S.
Заглавие : Structural aspects of phase transitions in crystals
Коллективы : European Meeting on Ferroelectricity
Место публикации : European Meeting on Ferroelectricity (5 ; 1983 ; Sept. ; 26-30 ; Malaga, Sp). Ferroelectrics. - 1983. - Vol. 53, Is. 1. - P.153-154. - ISSN 0015-0193, DOI 10.1080/00150198408245044
Ключевые слова (''Своб.индексиров.''): ferroelectric materials--lithium compounds - x-ray analysis--phase transitions--crystals
Аннотация: Modern X-ray methods obtain in a short time the complete set of structural amplitudes and solve a crystal structure at constant temperatures (or pressures) on both sides of phase transition. A review of structure investigations with the crystals having the common formula Me prime Me double prime BX//4 (Me prime , Me double prime equals Li, Na, K, Rb, Cs, NH//4 and H; BX//4**2** plus equals SO//4, SeO//4, BeF//4, ZnCl//4) is presented.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Alekseev K. N., Ponomarev A. V.
Заглавие : Optical chaos in nonlinear photonic crystals
Место публикации : JETP Letters. - 2002. - Vol. 75, Is. 4. - P.174-178. - ISSN 0021-3640, DOI 10.1134/1.1475717
Примечания : Cited References: 34
Предметные рубрики: POLED LITHIUM-NIOBATE
3RD-HARMONIC GENERATION
WAVE-GUIDES
SUPERLATTICES
CHI((2))
Аннотация: We examine the spatial evolution of lightwaves in a nonlinear photonic crystal with a quadratic nonlinearity, when a second harmonic and a sum-frequency generation are simultaneously quasi-phase-matched. We find the conditions for a transition to Hamiltonian chaos for different amplitudes of lightwaves at the crystal boundary. (C) 2002 MAIK "Nauka/ Interperiodica".
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Aleksandrov K. S., Turchin P. P., Sorokin B. P., Karpovich A. A., Nefedov V. A.
Заглавие : Bulk acoustic waves propagation in Li2B4O7 piezoelectric crystals under the static uniaxial mechanical pressure
Коллективы : Annual frequency control symposium
Место публикации : Proceedings of the Annual IEEE International Frequency Control Symposium/ Annual frequency control symposium (54 ; 2000 ; Jun. ; 7-9 ; Kansas, MO). - 2000. - P.214-217. - ISBN 01616404
Примечания : Cited References: 8
Ключевые слова (''Своб.индексиров.''): acoustic wave transmission--acoustic wave velocity--elasticity--lithium compounds--mathematical models--permittivity--piezoelectricity--pressure effects--single crystals--electromechanical constants--piezoelectric crystal--piezoelectric materials
Аннотация: The influence of uniaxial mechanical stresses on bulk acoustic waves velocity in piezoelectric crystals Li2B4O7 has been investigated. Electromechanical constants have determined.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Burkova S. I., Zolotova O. P., Sorokin B. P., Aleksandrov K. S.
Заглавие : Effect of external electrical field on characteristics of a Lamb wave in a piezoelectric plate
Место публикации : Acoust. Phys. - 2010. - Vol. 56, Is. 5. - P.644-650. - ISSN 1063-7710, DOI 10.1134/S1063771010050088
Примечания : Cited References: 11. - The work is supported within the Russian Federation Program for Supporting Scientific Schools, grant no. NSh-1011.2008.2.
Предметные рубрики: ACOUSTIC-WAVES
LITHIUM-NIOBATE
Аннотация: The influence of a homogeneous electrical field E on the characteristics and propagation conditions of the Lamb wave in a piezoelectric crystalline plate is considered on the basis of the theory of acoustic wave propagation in piezocrystals under the effect of an external electrical field.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Kuzubov A. A., Avramov P. V., Ovchinnikov S. G., Varganov S. A., Tomilin F. N.
Заглавие : Electronic and atomic structures of the isomers of endohedral and exohedral fullerene complexes with two lithium atoms
Место публикации : Phys. Solid State: MAIK NAUKA/INTERPERIODICA/SPRINGER, 2001. - Vol. 43, Is. 9. - P1794-1799. - ISSN 1063-7834, DOI 10.1134/1.1402242
Примечания : Cited References: 21
Предметные рубрики: VIBRATION-ROTATION BANDS
INFRARED ROTATION
C-60
BUCKMINSTERFULLERENE
ION
Аннотация: The electronic structures of all the possible isomers of endohedral and exohedral C(60) fullerene complexes with two lithium atoms are theoretically investigated. It is found that the electronic structures of these compounds are characterized by an impurity filled-level state determining the band gap. The location of the impurity state and, correspondingly, the band gap of the exohedral fullerene complexes depend on the coordination mode and the distance between the alkali metal ions. A similar dependence is observed for the total energy of the exohedral fullerene complex under investigation. (C) 2001 MAIK "Nauka/ Interperiodica".
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrov K. S., ANISTRATOV A. T., Melnikova S. V., Klevtsov P. V., Kruglik A. I., Voronov V. N.
Заглавие : Ferroelectricity in caesium lithium molybdate CsLiMoO4 and related crystals CsLiWO4 and RbLiMoO4
Коллективы : International meeting on ferroelectricity
Место публикации : International meeting on ferroelectricity (5 ; 1981 ; 17-21 Aug. ; Universal Park, USA). Ferroelectrics. - 1981. - Vol. 36, Is. 1. - P.399-402. - ISSN 0015-0193, DOI 10.1080/00150198108218138
Ключевые слова (''Своб.индексиров.''): cesium compounds--rubidium compounds--cesium lithium molybdate--cesium lithium tungstate--phase transitions--rubidium lithium molybdate--ferroelectric materials
Аннотация: Successive ferroelectric phase transitions were discovered in CsLiMoO//4, CsLiWO//4 and RbLiMoO//4 single crystals. Strong elastic and no dielectric anomalies were found with temperature lowering in the initial cubic phases. The phase transitions are qualitatively described as pseudoproper ferroelectric ones.
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10.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Golovnev N., Molokeev M. S.
Заглавие : Bridging behaviour of the 2-thiobarbiturate anion in its complexes with LiI and NaI
Место публикации : Acta Crystallographica Section C Crystal Structure Communications. - 2013. - Vol. 69, Pt. 7. - P.704-708. - ISSN 0108-2701, DOI 10.1107/S0108270113014078
Ключевые слова (''Своб.индексиров.''): 2-thiobarbituric acid--coordinated water--dihydrates--edge sharing--hydrogen bonding interactions--three-dimensional networks--atoms--complex networks--hydrogen bonds--ligands--negative ions--positive ions--three dimensional--lithium
Аннотация: The structures of the LiI and NaI salts of 2-thiobarbituric acid (2-sulfanylidene-1-3-diazinane-4,6-dione, H 2TBA) have been studied. μ-Aqua-octaaquabis(μ-2- thiobarbiturato-κ2 O:O′)bis(2-thiobarbiturato-κO) tetralithium(I) dihydrate, [Li4(C4H3N 2O2S)4(H2O)9]·2H 2O, (I), crystallizes with four symmetry-independent four-coordinated LiI cations and four independent HTBA- anions. The structure contains two structurally non-equivalent LiI cations and two non-equivalent HTBA- anions (bridging and terminal). Eight of the coordinated water ligands are terminal and the ninth acts as a bridge between LiI cations. Discrete [Li4(HTBA)4(H2O)9] ·2H2O complexes form two-dimensional layers. Neighbouring layers are connected via hydrogen-bonding interactions, resulting in a three-dimensional network. Poly[μ2-aqua-tetraaqua(μ4-2- thiobarbiturato-κ4 O:O:S:S)(μ2-thiobarbiturato- κ2 O:S)disodium(I)], [Na2(C4H 3N2O2S)2(H2O) 5] n , (II), crystallizes with six-coordinated NaI cations. The octahedra are pairwise connected through edge-sharing by a water O atom and an O atom from the μ4-HTBA- ligand, and these pairs are further top-shared by the S atoms to form continuous chains along the a direction. Two independent HTBA- ligands integrate the chains to give a three-dimensional network. © 2013 International Union of Crystallography.
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11.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Kuzubov A. A., Fedorov A. S., Eliseeva N. S., Tomilin F. N., Avramov P. V., Fedorov D. G.
Заглавие : High-capacity electrode material BC3 for lithium batteries proposed by ab initio simulations
Место публикации : Phys. Rev. B: American Physical Society, 2012. - Vol. 85, Is. 19. - Ст.195415. - ISSN 1098-0121, DOI 10.1103/PhysRevB.85.195415
Примечания : Cited References: 22. - We thank the Institute of Computer Modeling (Siberian Division, Russian Academy of Sciences, Russia), the Joint Supercomputer Center of the Russian Academy of Sciences, the supercomputer center of the Institute of Space and Information Technologies of the Siberian Federal University, and the supercomputer center of the Moscow State University (SKIF-MGU) for providing an opportunity to use their computers for performing all calculations. The work was supported by Russian Foundation for Basic Research Grant No. 12-02-00640-a and federal program Grant No. 1.3.2, "Scientific and pedagogical specialists in innovation Russia 2009-2013."
Предметные рубрики: TRANSITION
GRAPHITE
POINTS
CARBON
Аннотация: The absorption energy and diffusion rates of lithium atoms inside graphitelike boron carbide (BC3) crystal are investigated by the ab initio pseudopotential density-functionalmethod using generalized gradient approximation. It is shown that lithium may effectively intercalate this structure with the maximum lithium concentration corresponding to Li2BC3 stoichiometry, which is threefold in comparison to lithium in graphite. The potential barrier values for lithium diffusion both at low and maximum concentration are about 0.19 eV, so lithium atoms inside the BC3 structure can move easily. These findings suggest that boron carbide looks like a good candidate as an anode material in lithium ion batteries.
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12.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrov K. S., Zherebtsova L. I., Iskornev I. M., Kruglik A. I., Rozanov O. V., Flerov I. N.
Заглавие : Investigation of structural and physical properties of cesium-lithium double sulfate
Место публикации : Sov. Phys. Solid State. - 1980. - Vol. 22, Is. 12. - P.2150-2152. - ISSN 0584-5807; Phys. Solid State
Ключевые слова (''Своб.индексиров.''): lithium compounds--ferroelasticity--phase transitions--cesium compounds
Аннотация: A study was made of the temperature dependences of the integrated intensities of the 006 and 021 x-ray reflections, deviation of the angle gamma from 90 degree , NMR of **7Li, specific heat c//p, thermal expansion, and permittivity. Moreover, the effects of hydrostatic pressure on the phase transition were studied. It was definitely established that a ferroelastic phase transition of the second kind occurs at 202. 07 degree K and this transition does not alter the number of atoms in a unit cell.
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13.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Mel'nikova S. V., Kartashev A. V., Grankina V. A., Flerov I. N.
Заглавие : Investigation of the reconstructive phase transition between metastable (alpha) and stable (beta) modifications of the NH4LiSO4 crystal
Разночтения заглавия :авие SCOPUS: Investigation of the Reconstructive Phase Transition between Metastable (α) and Stable (β) Modifications of the NH4LiSO 4 Crystal
Место публикации : Phys. Solid State: AMER INST PHYSICS, 2003. - Vol. 45, Is. 8. - P1572-1578. - ISSN 1063-7834, DOI 10.1134/1.1602898
Примечания : Cited References: 13
Предметные рубрики: AMMONIUM LITHIUM-SULFATE
LINH4SO4
TEMPERATURE
Аннотация: Crystals of ammonium lithium sulfate NH4LiSO4 in alpha and beta modifications are studied, and conditions of their nucleation and growth are determined. The alpha modification of NH4LiSO4 and alpha--beta phase transitions are investigated using polarized light microscopy, x-ray diffraction, and differential scanning calorimetry in the temperature range 80-530 K. It is found that, depending on the conditions of growth and storage, there exist two temperature ranges (T(alpha--beta)approximate to340-350 and approximate to440-450 K) in which the crystals can undergo an alpha--beta reconstructive phase transition. The enthalpy of this transformation depends on the symmetry of the final phase. In the former case (340-350 K), the reconstructive phase transition leads to rapid destruction of the sample. In the latter case (440-450 K), the crystal structure undergoes a slow transformation (recrystallization) without noticeable distortions. The results obtained indicate that no structural phase transition occurs in the alpha modification of NH4LiSO4 at 250 K. (C) 2003 MAIK "Nauka/Interperiodica".
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14.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Isaenko L., Dong L., Kurus A., Lin Z., Yelisseyev A., Lobanov S., Molokeev M. S., Korzhneva K., Goloshumova A.
Заглавие : LixAg1–xGaSe2: interplay between lithium and silver in mid-infrared nonlinear optical chalcogenides
Место публикации : Adv. Opt. Mater. - 2022. - Vol. 10, Is. 24. - Ст.2201727. - ISSN 21951071 (ISSN), DOI 10.1002/adom.202201727
Примечания : Cited References: 37. - This work was supported by the National Natural Science Foundation of China (Grant No. 22133004), Russian Science Foundation, grant # 19‐12‐00085‐P (crystal growth, crystal structure analysis, band gap measurement) and partly done on state assignment of IGM SB RAS (composition chemical analysis)
Аннотация: AgGaSe2 and LiGaSe2 are two famous mid-infrared nonlinear optical (NLO) materials with similar chemical formula but different structural symmetry. The former material has relatively larger NLO effect and birefringence but rather small energy band gap, while the latter is the opposite. Aiming at achieving a good balance of NLO properties, here the substitution between silver and lithium ions on the evolution of structural and optical properties in a new series of LixAg1–xGaSe2 crystals is systematically investigated. It reveals that, with the increase of Li content, LixAg1–xGaSe2 almost keeps the same tetragonal symmetry with AgGaSe2 until x ≈ 0.9. The NLO effects and birefringence values vary with respect to x with the largest variation at x = 0.8–0.9. The optimal combination of birefringence (0.03–0.025) and nonlinear parameters (26–30 pm V−1) is achieved at x = 0.4–0.5. As the energy band gap increases with the increase of x, the maximal value of 2.2 eV for chalcopyrite structure suggests that the laser-induced damage threshold of LixAg1–xGaSe2 would be as large as five-fold of AgGaSe2. This study provides a good example to show that the rational substitution between Li and Ag can significantly improve the balance of NLO properties in chalcogenides.
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15.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Roessli B., Staub U., Amato A., Herlach D., Pattison P., Sablina K. A., Petrakovskii G. A.
Заглавие : Magnetic phase transitions in the double spin-chains compound LiCu2O2
Место публикации : Physica B. - 2001. - Vol. 296, Is. 4. - P.306-311. - ISSN 0921-4526, DOI 10.1016/S0921-4526(00)00574-3
Примечания : Cited References: 17
Предметные рубрики: ORDERED MOMENT
COPPER
CRYSTAL
LI2CUO2
Ключевые слова (''Своб.индексиров.''): muon-spin rotation--spin ladder--magnetic ordering--licu2o2--crystal structure--lithium compounds--magnetic anisotropy--magnetic field effects--magnetic relaxation--magnetization--order disorder transitions--specific heat of solids--x ray diffraction analysis--anisotropic line broadening--muon spin rotation--spin ladder--antiferromagnetic materials
Аннотация: We report high-resolution X-ray diffraction, muon-spin-rotation spectroscopic and specific heat measurements in the double spin-chains compound LiCu2O2. The X-ray diffraction results show that the crystal structure of LiCu2O2 is orthorhombic down to T = 10 K. Anisotropic line-broadening of the diffraction peaks is observed, indicating disorder along the spin chains. Muon-spin relaxation and specific heat measurements show that LiCu2O2 undergoes a phase transition to a magnetic ordered state at T-1 similar to 24 K. The specific heat data exhibits a second lambda -like peak at T-2 similar to 32.5 K, which increases with increasing magnetic field in a similar way to that found in spin-ladder compounds. (C) 2001 Elsevier Science B.V. All rights reserved.
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16.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Malakhovskii A. V., Isachenko V. A., Sukhachev A. L., Potseluyko A. M., Zabluda V. N., Zarubina T. V., Edelman I. S.
Заглавие : Magneto-optical properties of Dy3+ in oxide glasses: The origin of the magneto-optical activity of f-f transitions and its anomalous temperature dependence
Место публикации : Phys. Solid State: MAIK NAUKA/INTERPERIODICA/SPRINGER, 2007. - Vol. 49, Is. 4. - P701-707. - ISSN 1063-7834, DOI 10.1134/S1063783407040178
Примечания : Cited References: 28
Предметные рубрики: MAGNETIC CIRCULAR-DICHROISM
FLUOROZIRCONATE ZBLAN GLASS
OPTICAL-ABSORPTION SPECTRA
DOPED SODA GLASS
SPECTROSCOPIC PROPERTIES
FLUOROBORATE GLASSES
LITHIUM BORATE
IONS
PR3+
GADOLINIUM
Аннотация: The temperature dependence of the absorption spectra and magnetic circular dichroism due to f-f transitions from the H-6(15/2) to F-6 (5/2) and (6)(F (7/2) + H (5/2)) states in the Dy3+ ion in (Dy2O3-P2O5-SiO2-GeO2) and (Dy2O3-La2O3-Al2O3-B2O3-SiO2-GeO2) glasses and the temperature dependence of the Faraday effect were studied. The temperature dependence of the Faraday effect caused by f-d transitions was found to differ from that of the magnetic circular dichroism due to f-f transitions. It was shown that f-f transitions occur preferentially in Dy3+ ions associated into clusters. The origin of the paramagnetic magneto-optical activity of f-f transitions was analyzed. It was shown that the contributions to this activity can differ in value and sign and that the ratio between these contributions depends on the transition type. In some cases, this difference results in an anomalous temperature dependence of the magneto-optical activity.
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17.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Potseluyko A. M., Edelman I. S., Zabluda V. N., Bolsunovskaya O. A., Zamkov A. V., Parshikov S. A., Zaytsev A. I.
Заглавие : Magnetooptic activity of f-d and f-f electron transitions in Pr3+ in the glass matrix LiB3O5
Место публикации : Physica B. - 2000. - Vol. 291, Is. 1-2. - P.89-96. - ISSN 0921-4526, DOI 10.1016/S0921-4526(99)01869-4
Примечания : Cited References: 17
Предметные рубрики: FARADAY-ROTATION
OXIDE GLASSES
Ключевые слова (''Своб.индексиров.''): faraday rotation--magnetooptic activity--praseodymium--electron transitions--faraday effect--light absorption--lithium compounds--praseodymium compounds--faraday rotation--transition wavelength--optical glass
Аннотация: The results of absorption, Faraday rotation and magnetic circular dichroism measurements for glasses with the composition of LiB3O5 + Pr2O3 are presented. The effective wavelength of the transition giving the main contribution to Faraday rotation in these glasses is determined. The contributions of several f-f transitions to Faraday rotation are separated and their magnetooptical activities are evaluated in comparison with the activity of the f-d transition. (C) 2000 Elsevier Science B.V. All rights reserved.
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18.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Makarova I. P., Verin I. A., Aleksandrov K. S.
Заглавие : Structure and twinning of RbLiCrO4 crystals
Место публикации : Acta Crystallogr. B. - 1993. - Vol. 49. - P.19-28. - ISSN 0108-7681, DOI 10.1107/S0108768192006141
Примечания : Cited References: 14
Предметные рубрики: LITHIUM POTASSIUM-SULFATE
NEUTRON-DIFFRACTION
THERMAL VIBRATIONS
KLISO4
PROGRAM
LIKSO4
Аннотация: The crystal structures of the G3 (space group P31c) and G2 (space group P6(3)) phases of RbLiCrO4 have been determined from X-ray diffraction data (Mo Kalpha radiation) at 293, 428, 493 and 523 K (G3 phase) and 553 and 583 K (G2 phase). The RbLiCrO4 crystals exhibit twinning by merohedry with twin laws in the G3 phase: 2 parallel-to [001], m perpendicular-to [001], 1BAR; in the G2 phase: m parallel-to [001], 2 perpendicular-to [001], 1BAR. The analysis of diffraction intensities and influence of anomalous scattering on them provided the unambiguous determination of the twin laws for all the specimens investigated. The structure has been refined using the approximation of the anharmonic thermal vibrations of atoms.
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19.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Makarova I. P., Verin I. A., Aleksandrov K. S.
Заглавие : X-ray diffraction study of RbLiCrO4
Коллективы : European meeting on ferroelectricity
Место публикации : Ferroelectrics. - 1991. - Vol. 124, Is. 1. - P.91-96. - ISSN 0015-0193, DOI 10.1080/00150199108209420
Примечания : Cited References: 12
Предметные рубрики: LITHIUM POTASSIUM-SULFATE
THERMAL VIBRATIONS
CRYSTALS
PROGRAM
KLISO4
LIKSO4
Аннотация: Crystal structure of RbLiCrO4 was determined in G3 phase (sp. gr. P31c) at 293, 428, 493, 523 K and in G2 phase (sp. gr. P63) at 553, 583 K applying X-ray diffraction data. The investigated crystals exhibit ‘twinning by merohedry’. The analysis of intensities and influence of anomalous scattering on them allowed us to choose twin elements and atomic configurations of twin domains for all the investigated specimens.
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20.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Mel'nikova S. V., Grankina V. A.
Заглавие : Optical investigations of the effect of gradual substitution NH4 - Cs on the ferroelastic phase transition in a CsLiSO4 crystal
Разночтения заглавия :авие SCOPUS: Optical Investigations of the Effect of Gradual Substitution NH4 Cs on the Ferroelastic Phase Transition in a CsLiSO4 Crystal
Место публикации : Phys. Solid State: AMER INST PHYSICS, 2004. - Vol. 46, Is. 3. - P515-520. - ISSN 1063-7834, DOI 10.1134/1.1687871
Примечания : Cited References: 14
Предметные рубрики: AMMONIUM LITHIUM-SULFATE
TEMPERATURE PHASE
NH4LISO4
Аннотация: Crystals of Cs-x(NH4)(1 - x)LiSO4 (0.39 less than or equal to x less than or equal to 1.0) solid solutions are grown and investigated using polarized light microscopy and measurements of the birefringence in the temperature range 100-530 K. The (x-T) phase diagram of the Cs-x(NH4)(1 - x)LiSO4 solid solutions is constructed. It is demonstrated that, upon substitution of ammonium for cesium in the CsLiSO4 crystal, the phase transition temperature gradually increases to such a degree that the ferroelastic phase can exist at room temperature. The triple point of intersection of the Pmcn, P2(1)cn, and P112(1)/n phase boundaries is determined. It is established that the introduction of ammonium in small amounts has an unusually strong effect on the refractive properties and character of the ferroelastic phase transition in the CsLiSO4 crystal. (C) 2004 MAIK "Nauka / Interperiodica".
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