Numerical Simulation of the Multicomponent Mass Transfer during Bridgman Growth of CdZnTe Crystal Using Maxwell-Stefan Diffusion Model

To reveal the complicated mechanism of the multicomponent mass transfer during the growth of ternary compound semiconductors, a numerical model based on Maxwell-Stefan equations was developed to simulate the Bridgman growth of CdZnTe crystal. The Maxwell-Stefan diffusion coefficients in the melt were estimated. Distributions of Zn, Cd, and Te were calculated with variable ampoule traveling rate and diffusion coefficients. The experimental results show that Zn in melt near the growth interface decreases and diffuses from the bulk melt to the growth interface. For Cd, the situation is just the opposite. The coupling effects of Zn and Cd diffusions result in an uphill diffusion of Te at the beginning of the growth. Throughout the growth, the concentration of Te in the melt keeps low near the growth interface but high far from the growth interface. Increasing the ampoule traveling rate will aggravate the segregation of Zn and Cd, and hence deteriorate the uniformity of Te. We also find that not only the diffusion coefficients but also the ratios between them have significant influence on the species diffusions.

Theoretical Analysis and Computer Simulation of Different Balance Bridge Voltage Controlled Crystal Oscillator

Q -double effect of different balance bridge voltage controlled crystal oscillator (DBVCXO) is quantitatively analysed by the computer simulation

Numerical Simulation of the Scavenging Rates of Ice Crystals of Various Microphysical Characteristics

Numerical models of trajectories of small aerosol spheres relative to oblate spheroids were used to determine ice crystal scavenging efficiencies. The models included the effects of aerodynamic flow about the ice particle, gravity, aerosol particle inertia and drag and electrostatic effects. Two electric configurations of the ice particle were investigated in detail. The first applied a net charge to the ice particle, of magnitude equal to the mean thunderstorm charge distribution, while the second applied a charge distribution, with no net charge, to the ice particle to model the electric multipole charge distribution. The results show that growing ice crystals with electric multipoles are better scavengers than single ice crystals with net thunderstorm charges, especially in the Greenfield gap (0.1 to 1.0 um), and that larger single crystals are better scavengers than smaller single crystals. The results also show that the low density ice crystals are more effective scavengers with net charges than they are with charge distribution.

A Modified Phase-Field Model for Polymer Crystal Growth

The irrationality of existing phase field model is analyzed and a modified phase-field model is proposed for polymer crystal growth, in which the parameters are obtained from real materials and very simple to use, and most importantly, no paradoxical parameters appeared in the model. Moreover, it can simulate different microstructure patterns owing to the use of a new different free energy function for the simulation of morphologies of polymer. The new free energy function considers both the cases of T〈Tm and T≥Tm, which is more reasonable than that in published literatures that all ignored the T≥Tm case. In order to show the validity of the modified model, the finite difference method is used to solve the model and different crystallization morphologies during the solidification process of isotactic polystyrene are obtained under different conditions. Numerical results show that the growth rate of the initial secondary arms is obviously increased as the anisotropy strength increases. But the anisotropy strength seems to have no apparent effect on the global growth rate. The whole growth process of the dendrite depends mainly upon the latent heat and the latent heat has a direct effect on the tip radius and tip velocity of side branches.

Study on Strength and Life of Anisotropic Single Crystal Blade - Part Ⅱ: Experimental Research

The single crystal blade is one of the key technologies for improving the performance, durability and reliability of aero-engines and ground gas-turbine engines. However, the anisotropic mechanical properties of the single crystal material makes a great deal of difficulties on the development and the application of the single crystal blade, which is a challenge for the engineering application of the single crystal superalloy and the theoretic bases of the application. Some researches on the strength analysis and the life prediction of the anisotropic single crystal blade were carried out by the authors' research team. They are as follows. The crystallographic constitutive models for the plastic and the creep behaviors and the method of the rupture life prediction were established and verified. The tensile or the creep experiments for DD3 single crystal alloy with different orientations under different temperatures and different tensile rates or under different temperatures and different stress levels were carried out. The experimental data and the anisotropic properties at intermediate and high temperatures revealed by the experiments are significant for the application of the single crystal alloy. In addition, the experimental research for a kind of single crystal blade was also made. As the application of the researches the strength analysis and the life prediction were carried out for the single crystal blade of a certain aeroengine. In this part, the experimental research work is describled, and the constitutive models and applications have been described in part I.

Research on the nanometric machining of a single crystal nickel via molecular dynamics simulation

Molecular dynamics simulations are employed to study the nanometric machining process of single crystal nickel. Atoms from different machining zones had different atomic crystal structures owing to the differences in the actions of the cutting tool. The stacking fault tetrahedral was formed by a series of dislocation reactions, and it maintained the stable structure after the dislocation reactions. In addition, evidence of crystal transition and recovery was found by analyzing the number variations in different types of atoms in the primary shear zone, amorphous region, and crystalline region. The effects of machining speed on the cutting force, chip and subsurface defects, and temperature of the contact zone between the tool and workpiece were investigated. The results suggest that higher the machining speed, larger is the cutting force. The degree of amorphousness of chip atoms and the depth and extent of subsurface defects increase with the machining speed. The average friction coefficient first decreases and then increases with the machining speed because of the temperature difference between the chip and machining surface.

Simulation of secondary nucleation of polymer crystallization via a model of microscopic kinetics

We present simulations of the mechanism of secondary nucleation of polymer crystallization,based on a new model accounting for the microscopic kinetics of attaching and detaching.As the key feature of the model,we introduced multibody-interaction parameters that establish correlations between the attaching and detaching rate constants and the resulting thickness and width of the crystalline lamella.Using MATLAB and Monte Carlo method,we followed the evolution of the secondary nuclei as a function of various multibody-interaction parameters.We identified three different growth progressions of the crystal：（i） Widening,（ii） thickening and（iii） simultaneously thickening and widening of lamellar crystals,controlled by the corresponding kinetic parameters.