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In the present paper an analytical potential form is used for overlap repulsive energy, derived by Harrison from quantum mechanical considerations, along with the composite effect of three-body forces and intersublattice displacement. The short-range overlap parameters in Harrison's potential form have direct correlation with the valence state energies for outermost electrons. The potential model is applied to calculate the third and fourth order elastic constants, first and second pressure derivatives of second order elastic constants, Grüneisen parameter and its volume dependence, Anderson parameter, and thermal expansion coefficient for three non-centrosymmetric crystals, viz. CaF2, SrF2 and BaF2. The calculated values of various physical quantities are found to be in good agreement with experimental data.The authors are grateful to Dr. Mansour Khalef, the Head of Physics Department, TNRC, Tajura (Tripoli) for the facilities and encouragements. 相似文献
3.
The structural properties of polycrystalline silicon films, prepared by plasma enhanced chemical vapor deposition system, with different flow rates of SiH4/SiF4 mixtures at 300 °C were investigated. This study indicates that the low hydrogen coverage on the growing surface, under optimum fluorine radicals, will be leaded to an improvement of crystallized area as compared with case of high hydrogen coverage surface. Moreover, the studies of the role of SiH4 and SiF4 radicals show that the SiH4 radicals are important in the nucleation and growth of grains. However, SiF4 radicals are effective in the structural change of grain boundaries regions and by this way, in the present system, establish the growth of grains under the dominant 〈1 1 0〉 direction. The stress investigation indicates that addition of high flow rate of SiF4 in amorphous film, results in the nearly stress free films. Finally, we found that the changes in g-value reflect the changes in the intrinsic compressive and tensile stress in the both polycrystalline and amorphous silicon films. 相似文献
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Adel A. George Michael 《Arkiv f?r Matematik》2006,44(1):92-96
In this paper, we generalize a theorem of Kallman [2, Theorem 1.1] and we resolve the unsettled case there. 相似文献
6.
The centrosymmetric title compound, [Cd2{CH3OC6H4P(OC5H9)S2}4], features an eight‐membered [? Cd? S? P? S? ]2 ring owing to the presence of bridging dithiolate ligands. Tetrahedral coordination geometries for cadmium are completed by chelating ligands. Copyright © 2004 John Wiley & Sons, Ltd. 相似文献
7.
G. Lefvre A. Hamza M. Fdoroff F. Carrette H. Cordier 《Colloids and surfaces. A, Physicochemical and engineering aspects》2006,280(1-3):32-38
A simple experimental approach was developed to determine the adhesion rate of particles onto massive substrate. Turbidimetry measurements are used to follow the evolution of particle concentration in a suspension in dynamic contact with the walls of a vessel made of different materials. This method allows to rapidly obtain qualitative results about the adhesion of metallic oxides particles on massive substrates. Adhesion of particles of charged latex onto glass was used to validate the approach and was shown to be a method to determine isoelectric points (IEP) of massive substrates. Then, the adhesion of an iron oxide (hematite) particles onto several substrates was studied to determine the reactivity of current labware (glass, polypropylene) and on a metal (aluminum) commonly found in industrial fouling problems. Adhesion of hematite was found to be pH-dependant, and occurs only below ca. 6 (glass) or 7 (polypropylene), and above 7 (aluminum). DLVO calculations were performed to model the hematite/water/glass system and are consistent with the experimental results. Experiments at temperature 7–50 °C have shown an increasing of the adhesion rate from 7 to 40 °C, then a constant value until 50 °C. 相似文献
8.
Budde F Hamza AV Ferm PM Ertl G Weide D Andresen P Freund H 《Physical review letters》1988,60(15):1518-1521
9.
Hans Zimmer R. Palmer-Sungail Douglas Ho Adel Amer 《Journal of heterocyclic chemistry》1993,30(1):161-167
The reaction pathway towards formation of 4-aroyl-3-hydroxy-2(5H)-furanones 1 from the base catalyzed reaction between an acetophenone, diethyl oxalate and formaldehyde was investigated. If methoxide was used as base, a transesterification was found to occur in the first step, while a side reaction, namely the retro Claisen reaction, was in competition with the desired lactone formation in the second step. The nature of the solvent and the acidic character of 1 as well as the basicity of the aminoarylene were found to have a profound influence on the course of the reaction of 1 with aminoarylenes. 相似文献
10.
Adel Attia Markéta Zukalová Jiří Rathouský Arnošt Zukal Ladislav Kavan 《Journal of Solid State Electrochemistry》2005,9(3):138-145
A mesoporous electrode material whose structure is composed of anatase nanocrystals stabilized by alumina is reported. Powder X-ray diffraction shows the anatase phase only, but micro-Raman spectroscopy shows that the materials have a core-shell morphology with grains of bulk anatase covered by a thin rutile layer on the surface. This structure is unique when compared to analogous materials stabilized by zirconia (PNNL-1). Nitrogen adsorption isotherms demonstrate a monotonous increase in surface area and mesopore volume with increasing Al content. Thin film electrodes from these materials were characterized by lithium insertion electrochemistry. Cyclic voltammograms exhibit significant differences in Li accommodation in Al-free and Al-stabilized materials. 相似文献