scholarly journals Особенности процессов переноса заряда в нанокомпозитах на основе полифениленоксида с фуллереном и эндофуллереном

2021 ◽  
Vol 63 (10) ◽  
pp. 1706
Author(s):  
А.А. Кононов ◽  
Н.А. Никонорова ◽  
Р.А. Кастро
Keyword(s):  
Charge Transfer ◽  
Polymer Nanocomposites ◽  
Theoretical Models ◽  
Mean Free Path ◽  
Fullerene C60 ◽  
Polyphenylene Oxide ◽  
Conductivity Type ◽  
Temperature Dependences ◽  
The Mean ◽  
Transfer Parameters

The paper presents the results of studying the processes of electric charge transfer in polymer nanocomposites based on polyphenylene oxide with fullerene C60 (1% and 8%) and with endometallofullerene Fe@C60 (1%) as nanofillers. The existing theoretical models were used to calculate the values of the charge transfer parameters, such as the carrier concentration N, the mean free path Rω, and the height of the potential barrier W. The conductivity type was determined for all samples by analyzing the temperature dependences of the exponent s.

Temperature Dependences in the O + OH → O2 + H Reaction. Quasiclassical Trajectory Calculation

1993 ◽  
Vol 58 (2) ◽  
pp. 234-243 ◽  
Author(s):  
Viliam Klimo ◽  
Martina Bittererová ◽  
Stanislav Biskupič ◽  
Ján Urban ◽  
Miroslav Micov
Keyword(s):  
Temperature Dependence ◽  
Energy Surface ◽  
Analytical Form ◽  
Mean Values ◽  
Quantum Numbers ◽  
Mean Lifetime ◽  
Temperature Dependences ◽  
Quasiclassical Trajectory Calculation ◽  
The Mean ◽  
Combustion Processes

The reaction O + OH → O2 + H in conditions of combustion of hydrocarbons and polymers was modelled by using the method of quasiclassical trajectories. The potential energy surface was determined by the multiconfiguration interaction method and fitted with the analytical form of the extended LEPS function. Attention was paid to the mean values of the vibrational and rotational quantum numbers of O2 molecules and their temperature dependence. The temperature dependence of the mean lifetime of the OOH collision complex was also examined. The calculated rate constants were analyzed and compared with the experimental data over the temperature region of the combustion processes.

scholarly journals Ballistic Heat Transport in Nanocomposite: The Role of the Shape and Interconnection of Nanoinclusions

Nanomaterials ◽  
2021 ◽  
Vol 11 (8) ◽  
pp. 1982
Author(s):  
Paul Desmarchelier ◽  
Alice Carré ◽  
Konstantinos Termentzidis ◽  
Anne Tanguy
Keyword(s):  
Thermal Conductivity ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Free Path ◽  
Mean Free Path ◽  
Strong Increase ◽  
Moderate Increase ◽  
Energy Propagation ◽  
The Mean ◽  
Dynamics Simulations

In this article, the effect on the vibrational and thermal properties of gradually interconnected nanoinclusions embedded in an amorphous silicon matrix is studied using molecular dynamics simulations. The nanoinclusion arrangement ranges from an aligned sphere array to an interconnected mesh of nanowires. Wave-packet simulations scanning different polarizations and frequencies reveal that the interconnection of the nanoinclusions at constant volume fraction induces a strong increase of the mean free path of high frequency phonons, but does not affect the energy diffusivity. The mean free path and energy diffusivity are then used to estimate the thermal conductivity, showing an enhancement of the effective thermal conductivity due to the existence of crystalline structural interconnections. This enhancement is dominated by the ballistic transport of phonons. Equilibrium molecular dynamics simulations confirm the tendency, although less markedly. This leads to the observation that coherent energy propagation with a moderate increase of the thermal conductivity is possible. These findings could be useful for energy harvesting applications, thermal management or for mechanical information processing.

Sputtering pressure dependence of hydrogen-sensing effect of palladium films

2009 ◽  
Vol 24 (6) ◽  
pp. 1919-1927 ◽  
Author(s):  
Chung Wo Ong ◽  
Yu Ming Tang
Keyword(s):  
Electrical Resistivity ◽  
Magnetron Sputtering ◽  
Mean Free Path ◽  
Induced Response ◽  
Resistivity Ratio ◽  
Hydrogen Sensing ◽  
The Mean ◽  
Sputtering Pressure ◽  
Specific Volumes ◽  
Hydride Phases

The electrical resistivity ρ of palladium (Pd) films prepared by using magnetron sputtering at different pressures φ ranging from 2 to 15 mTorr showed very different hydrogen (H)-induced response. This reaction is because the mean free path of the particles in vacuum changes substantially with φ, such that the structure of the deposits is altered accordingly. A film prepared at a moderate φ value of 6 mTorr has a moderate strength. After a few hydrogenation-dehydrogenation cycles, some cracks are generated because of the great difference in the specific volumes of the metal and hydride phases. Breathing of the cracks in subsequent switching cycles occurred, which led to the response gain of ρ, defined as the resistivity ratio of the dehydrogenated-to-hydrogenated states during a cycle, to increase to 17. This result demonstrates the attractiveness of using the Pd films in H2 detection application. The H-induced resistive response of the films prepared at other φ values was found to be much smaller.

Experiments on the flow of heat in liquid helium below 0.7 °K

1958 ◽  
Vol 246 (1246) ◽  
pp. 390-405 ◽  
Keyword(s):  
Thermal Conductivity ◽  
Liquid Helium ◽  
Free Path ◽  
Empirical Relation ◽  
Mean Free Path ◽  
Series Of Experiments ◽  
The Mean ◽  
Set Up ◽  
Low Pressures ◽  
Measured Thermal Conductivity

A series of experiments has been performed to study the steady flow of heat in liquid helium in tubes of diameter 0.05 to 1.0 cm at temperatures between 0.25 and 0.7 °K. The results are interpreted in terms of the flow of a gas of phonons, in which the mean free path λ varies with temperature, and may be either greater or less than the diameter of the tube d . When λ ≫ d the flow is limited by the scattering of the phonons at the walls, and the effect of the surface has been studied, but when λ ≪ d viscous flow is set up in which the measured thermal conductivity is increased above that for wall scattering. This behaviour is very similar to that observed in the flow of gases at low pressures, and by applying kinetic theory to the problem it can be shown that the mean free path of the phonons characterizing viscosity can be expressed by the empirical relation λ = 3.8 x 10 -3 T -4.3 cm. This result is inconsistent with the temperature dependence of λ as T -9 predicted theoretically by Landau & Khalatnikov (1949).

Light scattering by phonons in the presence of a heat flow

1968 ◽  
Vol 46 (24) ◽  
pp. 2843-2845 ◽  
Author(s):  
Allan Griffin
Keyword(s):  
Light Scattering ◽  
Heat Flow ◽  
Temperature Gradient ◽  
Free Path ◽  
Mean Free Path ◽  
Photon Scattering ◽  
The Mean ◽  
Anti Stokes

If the temperature in an insulating crystal decreases in the z-direction, there are more phonons with momentum qz > 0 than with qz < 0. The resulting difference between the Stokes and anti-Stokes Brillouin intensities is proportional to the mean free path of the phonon involved and to the temperature gradient. The effect should be observable by either neutron or photon scattering.

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