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The structural, mechanical, electronic and optical properties of orthorhombic PtSi and PtGe were investigated using norm-conserving pseudopotentials within the local density approximation in the frame of density functional theory. The calculated lattice parameters and bulk modulus for PtSi and PtGe have been compared with the experimental and theoretical values. The second-order elastic constants were calculated, and the other related quantities such as the Young's modulus, shear modulus, Poisson's ratio, anisotropy factor, sound velocities and Debye temperature have also been estimated. The linear photon-energy dependent dielectric functions and some optical properties such as the energy-loss function, the effective number of valance electrons and the effective optical dielectric constant were calculated. Our structural estimation and some other results are in agreement with the available experimental and theoretical data. 相似文献
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108.
M. -H. Yu. Seyidov R. A. Suleymanov S. S. Babaev T. G. Mamedov G. M. Sharifov 《Physics of the Solid State》2008,50(1):108-117
The effect of external fields (dc electric field, light illumination) on the memory effect of the incommensurate phase in the ferroelectric-semiconductor TlGaSe2 is studied using the measured dielectric constant. The results obtained are discussed. It is shown for the first time that the effect of external fields on the anomaly related to the memory effect in TlGaSe2 can be reduced to the following universal empirical rule: when a sample is held for many hours at a constant temperature T 0 in the temperature range of the incommensurate phase in a dc electric field, the deflection amplitude in the low-temperature part of the anomaly in the temperature dependence of the relative change in the dielectric constant Δ?/? increases (the deflection in the high-temperature part of the Δ?/? anomaly disappears) as compared to this segment in the dependence obtained during isothermal annealing of this sample at the same temperature without an electric field. The crystal remembers its thermal history at a temperature that is several kelvins higher than T 0. Light illumination increases the deflection amplitude in the high-temperature part of the Δ?/?(T) anomaly and shifts the temperature at which the crystal remembers its thermal history toward lower temperatures with respect to T 0. 相似文献
109.
V. M. Mamedov V. S. Yuferev S. I. Bakholdin Yu. G. Nosov 《Crystallography Reports》2008,53(7):1194-1202
A three-dimensional model is proposed for the global heat exchange during growth of basal-plane-faceted sapphire ribbons.
The model is based on the method for solving three-dimensional problems of radiative heat transfer in complex regions with
diffusely and specularly reflecting boundaries. The temperature distributions in the ribbon and elements of the thermal zone
are investigated. It is shown that the developed model correctly reflects the main features of the processes of heat exchange
in the crystallization setup and makes it possible to purposefully modify the thermal zone. 相似文献
110.
B.A. Mamedov 《Journal of Quantitative Spectroscopy & Radiative Transfer》2008,109(7):1277-1280
New analytical results are presented performing to cylindrical exponential integral (CEI) functions for integer and noninteger values of parameter n. These integrals are often employed of two-dimensional radiative transfer in an absorbing-emitting medium and determination of the radiative flux in cylindrical media. The simple and efficient algorithm for the calculation of these functions is developed. The series expansion relations established in this work are accurate enough in the whole range of parameters. 相似文献