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排序方式: 共有139条查询结果,搜索用时 15 毫秒
21.
Jelena Tamuliene Liudmila G. Romanova Vasyl S. Vukstich Alexander V. Papp Alexander V. Snegursky 《The European Physical Journal D - Atomic, Molecular, Optical and Plasma Physics》2014,68(5):1-17
The fragmentation of the hydrated and anhydrous asparagine molecule (C4H8N2O3) under a low-energy electron impact was studied both experimentally and theoretically. The main emphasis was given to the mechanisms of the fragment production of these molecules. A special attention was paid to the energy characteristics of the ionic fragment yield. The geometrical parameters of the initial molecule rearrangement were also analyzed. 相似文献
22.
Marat Gafurov Vasyl Denysenkov Mark J. Prandolini Thomas F. Prisner 《Applied magnetic resonance》2012,43(1-2):119-128
The temperature dependence of the water-proton dynamic nuclear polarization (DNP) enhancement from Fremy’s salt nitroxide radicals was measured in a magnetic field of 9.2?T (corresponding to 260?GHz microwave (MW) and 392?MHz NMR frequencies) in the temperature range of 15–65?°C. The temperature could be determined directly from the proton NMR line shift of the sample. Very high DNP enhancements of ?38 (signal integral) or ?81 (peak intensity) could be achieved with a high-power gyrotron MW source. The experimental findings are compared with classical Overhauser theory for liquids, which is based on the translational and rotational motion of the molecules and with molecular dynamics calculations of the coupling factor. 相似文献
23.
Pivovarenko VG Zamotaiev OM Shvadchak VV Postupalenko VY Klymchenko AS Mély Y 《The journal of physical chemistry. A》2012,116(12):3103-3109
By using four labels of the 3-hydroxyflavone family displaying selective sensitivity to hydrogen bond (HB) donors and poor response to other polar molecules, we developed an approach for measuring local water concentration [H(2)O](L) (or partial volume of water: W(A) = [H(2)O](L)/55.6) in the label surrounding both in solvent mixtures and in biomolecules by the intensity ratio of two emissive forms of the label, N*/T*. Using a series of binary water/solvent mixtures with limited preferential solvation effects, a linear dependence of log(N*/T*) on the local concentration of HB donor was obtained and then used as a calibration curve for estimating the W(A) values in the surroundings of the probes conjugated to biomolecules. By this approach, we estimated the hydration of the labels in different peptides and their complexes with DNAs. We found that W(A) values for the label at the peptide N-terminus are lower (0.63-0.91) than for free labels and depend strongly on the nature of the N-terminal amino acid. When complexed with different DNAs, the estimated hydration of the labels conjugated to the labeled peptides was much lower (W(A) = 0-0.47) and depended on the DNA nature and linker-label structure. Thus, the elaborated method allows a site-specific evaluation of hydration at the surface of a biomolecule through the determination of the partial volume of water. We believe the developed procedure can be successfully applied for monitoring hydration at the surface of any biomolecule or nanostructure. 相似文献
24.
The indides Eu2Pd2In and Eu2Pt2In were synthesized from the elements in sealed tantalum tubes in an induction furnace. The samples were characterized by powder X‐ray diffraction. The structures were refined on the basis of single‐crystal X‐ray diffractometer data: HT‐Pr2Co2Al type, C2/c, a = 1035.7(2), b = 592.9(1), c = 823.6(2) pm, β = 104.26(1) °, wR2 = 0.026, 1075 F2 values, 25 variables for Eu2Pd2In and a = 1017.2(2), b = 588.7(1), c = 826.5(1) pm, β = 103.76(1) °, wR2 = 0.062, 706 F2 values, 25 variables for Eu2Pt2In. The indium atoms have four platinum (palladium) neighbors in strongly distorted tetrahedral coordination at Pt–In and Pd–In distances ranging from 273 to 275 pm. These InPd4/2 and InPt4/2 units are condensed via common edges to infinite InPd2 and InPt2 chains, which are surrounded by the europium atoms. The chains form the motif of hexagonal rod packing. 相似文献
25.
Dmytro Kharchenko Vasyl Kharchenko Iryna Lysenko 《Central European Journal of Physics》2011,9(3):698-709
We apply the phase field crystal method for nonequilibrium patterning to stochastic systems with an external source in which
transient dynamics is essential. Considering a prototype model for a one-component periodic system subjected to external influence
kind of irradiation we study properties of pattern selection processes and external noise induced pattern-forming transitions.
These processes are examined by means of the structure function dynamics analysis. Nonequilibrium pattern-forming transitions
are analyzed numerically. 相似文献
26.
27.
Dmitry G. Luchinsky Halyna Hafiychuk Vasyl Hafiychuk Kenta Chaki Hiroya Nitta Taku Ozawa Kevin R. Wheeler Tracie J. Prater Peter V. E. McClintock 《Journal of polymer science. Part A, Polymer chemistry》2020,58(15):2051-2061
We consider an atomistic model of thermal welding at the polymer-polymer interface of a polyetherimide/polycarbonate blend, motivated by applications to 3D manufacturing in space. We follow diffusion of semiflexible chains at the interface and analyze strengthening of the samples as a function of the welding time tw by simulating the strain–stress and shear viscosity curves. The time scales for initial wetting, and for fast and slow diffusion, are revealed. It is shown that each component of the polymer blend has its own characteristic time of slow diffusion at the interface. Analysis of strain–stress demonstrates saturation of the Young's modulus at tw = 240 ns, while the tensile strength continues to increase. The shear viscosity is found to have a very weak dependence on the welding time for tw > 60 ns. It is shown that both strain–stress and shear viscosity curves agree with experimental data. 相似文献
28.
29.
Svetlana L. Yefimova Irina Yu. Kurilchenko Tatyana N. Tkacheva Nataliya S. Kavok Igor N. Todor Nataliya Yu. Lukianova Vasyl F. Chekhun Yuriy V. Malyukin 《Journal of fluorescence》2014,24(2):403-409
We report the Förster resonance energy transfer (FRET)-labeling of liposomal vesicles as an effective approach to study in dynamics the interaction of liposomes with living cells of different types (rat hepatocytes, rat bone marrow, mouse fibroblast-like cells and human breast cancer cells) and cell organelles (hepatocyte nuclei). The in vitro experiments were performed using fluorescent microspectroscopic technique. Two fluorescent dyes (DiO as the energy donor and DiI as an acceptor) were preloaded in lipid bilayers of phosphatidylcholine liposomes that ensures the necessary distance between the dyes for effective FRET. The change in time of the donor and acceptor relative fluorescence intensities was used to visualize and trace the liposome-to-cell interaction. We show that FRET-labeling of liposome vesicles allows one to reveal the differences in efficiency and dynamics of these interactions, which are associated with composition, fluidity, and metabolic activity of cell plasma membranes. 相似文献
30.
Oleg Korotchenkov Andriy Nadtochiy Vasyl Kuryliuk Chin-Chi Wang Pei-Wen Li Andres Cantarero 《The European Physical Journal B - Condensed Matter and Complex Systems》2014,87(3):1-8
The efficiency of the energy conversion devices depends in many ways on the materials used and various emerging cost-effective nanomaterials have promised huge potentials in highly efficient energy conversion. Here we show that thermoelectric voltage can be enhanced by a factor of 3 using layer-cake growth of Ge quantum dots through thermal oxidation of SiGe layers stacked in SiO2/Si3N4 multilayer structure. The key to achieving this behavior has been to strain the Ge/Si interface by Ge dots migrating to Si substrate. Calculations taking into account the carrier trapping in the dot with a quantum transmission into the neighboring dot show satisfactory agreement with experiments above ≈200 K. The results may be of interest for improving the functionality of thermoelectric devices based on Ge/Si. 相似文献