• Bulletin of the Korean Chemical Society
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• v.16 no.5
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• pp.436-438
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• 1995

Based on the collisional time-correlation function approach a general analytical expression has been derived for the double differential cross-section with respect to the scattering angle and the final rotational energy, which can be applied to molecules with non-zero electronic orbital angular momentum after collision with fast hydrogen atoms. By integrating this expression another very simple expression, which gives the final rotational distribution as a function of the rotational quantum number, has also been derived. When this expression is applied to NO(2Π1/2, v'=1) and NO(2Π3/2, v'=1, 2, 3), it can reproduce the experimental rotational distribution after collision with fast H atom very well. The average rotational quantum number and average rotational energy using this expression are also in good agreement with those deduced from the experimental distributions.

• Bulletin of the Korean Chemical Society
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• v.19 no.6
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• pp.634-641
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• 1998

Quasiclassical trajectory calculations were carried out for the reactions of $H+H_2$ (V=O, J=O) and its isotope variants on the Siegbahn-Liu-Truhlar-Horowitz potential energy surface for the relative energies E between 6 and 150 kcal/mol. The goal of the work was to understand the inter- and intramolecular isotope effects. We examine the relative motion of reactants during the collision using the method of analysis that monitors the intermolecular properties (internuclear distances, geometry of reactants, and final product). As in other works, we find that the heavier the incoming atom is, the greater the reaction cross section is at the same collision energy. Using the method of analysis we prove that the intermolecular isotope effect is contributed mainly by differences in reorientation due to the different reduced masses. We show that above E=30 kcal/mol recrossing also contributes to the intermolecular isotope effect. For the intramolecular isotope effect in the reactions of H+HD and T+HD, we reach the same conclusions as in the systems of $O(^3P)+HD$, F+HD, and Cl+HD. That is, the intramolecular isotope effect below E=150 kcal/mol is contributed by reorientation, recrossing, and knockout type reactions.

• Bulletin of the Korean Chemical Society
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• v.13 no.2
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• pp.187-192
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• 1992

The classical trajectory method, previously applied to the reactions of polyatomic molecules with fcc structured metal solids[S. C. Park, C. H. Cho, and C. H. Rhee, Bull. Kor. Chem. Soc., 11, $1(1990)]^1$ is extended to the collision energy dependence of the reaction of the Al solid by $SiCl_4$ molecules. We have calculated etching yields, degrees of anisotropy, kinetic energy distributions, and angular distributions for the reactions of the Al solid and compared with those for the reactions of the Cu solid. Over the range of collision energies we considered, the reactions of the Al soIid show higher etching yield and better anisotropy than the reactions of the Cu solid. Details of reaction mechanisms and the relevance of these calculations for the dry etching of CuAl alloy are discussed.

• Transactions of the Korean Society of Mechanical Engineers A
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• v.39 no.9
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• pp.885-892
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• 2015

In this study, we simulate the railway crash accident that occurred at the Sangwangsimni station on the Seoul Metro Line #2, and we propose a solution to minimize the damage. We use LS-DYNA, which is the commercial software employed for collision analysis to perform 1-D and 3-D simulations for the recurrence of accidents. By performing 1-D simulations, we analyze the load, displacement, absorbed energy of the couplers, and acceleration of vehicles, and we evaluate the safety in accidental collisions. By performing 3-D simulations, we analyze the deformation of the car and over-ridding. We propose methods to improve the safety in collisions involving railway vehicles, and we perform collision accident simulations to determine improvements when applying a high-performance energy absorber to the front car.

• Journal of the Korean Chemical Society
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• v.20 no.2
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• pp.97-110
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• 1976

Effects of direct multiple quantum excitations in vibrational energy transfer were investigated. Vibrational transition probabilities for 0${\rightarrow}$2, 0${\rightarrow}$3, and 0${\rightarrow}$4 excitations were explicitly formulated including both direct 0→n excitations and stepwise single quantum processes. For the formulation the perturbing force was derived from the exponential potential including terms up to fourth order in the vibrational amplitude. The head-on collinear collision model between a harmonic oscillator and an incident particle was employed, and the formulation was based on the semiclassical approximation. Numerical results were obtained for five different collision systems (Ar${\cdots}$O-N, He${\cdots}$H-H, He${\cdots}$H-Cl, 5${\cdots}$1-2, 2${\cdots}$12-12). Comparison between the present results and those obtained using the linearized interaction potential showed that the overall effect of including the direct multiple quantum transition is to decrease the probabilities at low collision energies and to increase them at high energies. The present results were found to be significantly different from those obtained using the linearized potential for collision systems He${\cdots}$H-H, He${\cdots}$H-Cl, and 5${\cdots}$1-2. For systems Ar${\cdots}$O-N and 2${\cdots}$12-12 the differences were negligible.

• Tribology and Lubricants
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• v.31 no.1
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• pp.13-20
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• 2015

The impact beam, a beam-shaped reinforcement installed horizontally between the inside and outside panels of car doors, is gaining importance as a solution to meet the regulations on side collision of vehicles. In order to minimize pelvis injury which is the biggest injury happening to the driver and passengers when a vehicle is subject to side collision, energy absorption at the door impact beam should be maximized. For the inner panel, the thrust into the inside of the vehicle must be minimized. The impact beam should be as light as possible so that the extent of pelvis injury to the driver and passenger during side collision of the vehicle is minimal. To achieve this, the weight of the impact beam, has to be optimized. In this study, we perform a design analysis with a goal to reduce the weight of the current impact design by 30% while ensuring stability, reliability, and comparison data of the impact beam for mass production. We conduct three-point bending stress experiments on conventional impact beams and analyze the results. In addition, we use a side-door collision test apparatus to test the performance of beams made of three (different materials: steel, aluminum, and composite beams).

• Journal of Powder Materials
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• v.23 no.1
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• pp.54-60
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• 2016

This study focuses on fabricating silver flake powder by a mechanical milling process and investigating the formation of flake-shaped particles during milling. The silver flake powder is fabricated by varying the mechanical milling parameters such as the amount of powder, ball size, impeller rotation speed, and milling time of the attrition ballmill. The particle size of the silver flake powder decreases with increasing amount of powder; however, it increases with increasing impeller rotation speed. The change in the particle size of the silver flake powder is analyzed based on elastic collision between the balls, taking energy loss of the balls due to the powder into consideration. The change in the particle size of the silver flake powder with mechanical milling parameters is consistent with the change in the diameter of the elastic deformation contact area of the ball, due to the collision between the balls, with milling parameters. The flake-shaped silver particles are formed at the elastic deformation contact area of the ball due to the collision.

• Journal of the Korean Society of Manufacturing Technology Engineers
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• v.22 no.3_1spc
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• pp.566-572
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• 2013

In this study, a collision simulator for rolling stock that considers the plastic deformation of the car body and the dynamic characteristics of a coupler system was developed using Matlab/Simulink. Normally, a coupler system has functions for both connecting the individual car bodies and absorbing the impact energy. A coupler system is composed of a rubber buffer, hydraulic buffer, and deformation tube elements. The coupler system should protect the car body and prevent damage when the shunt speed is less than 10 km/h, which is the regulation speed based on the safety rule for rolling stock. However, if the shunt speed is greater than 10 km/h, a car body is plastically deformed. Therefore, the modeling of the plastic deformation of a car body should be included in a simulator. This collision simulator can provide the design parameters for a coupler system and car body.

• Bulletin of the Korean Chemical Society
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• v.34 no.8
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• pp.2473-2479
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• 2013

The kinetics of the radical-polar molecule reaction $CH_3+HBr{\rightarrow}CH_4+Br$ has been studied at temperatures between 150 and 1000 K using classical dynamics procedures. Potential energy surfaces constructed using analytical forms of inter- and intramolecular interaction energies show a shallow well and barrier in the entrance channel, which affect the collision dynamics at low temperatures. Different collision models are used to distinguish the reaction occurring at low- and high-temperature regions. The reaction proceeds rapidly via a complex-mode mechanism below room temperature showing strong negative temperature dependence, where the effects of molecular attraction, H-atom tunneling and recrossing of collision complexes are found to be important. The temperature dependence of the rate constant between 400 and 1000 K is positive, the values increasing in accordance with the increase of the mean speed of collision. The rate constant varies from $7.6{\times}10^{-12}$ at 150 K to $3.7{\times}10^{-12}$ at 1000 K via a minimum value of $2.5{\times}10^{-12}\;cm^3\;molecule^{-1}\;s^{-1}$ at 400 K.

• Journal of the Korean Physical Society
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• v.73 no.12
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• pp.1855-1862
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• 2018

A reliable set of low-energy electron collision cross sections for the triethoxysilane (TRIES) molecule was derived based on the measured electron transport coefficients for a pure TRIES molecule by using an electron swarm method and a two-term approximation of the Boltzmann equation. The electron transport coefficients calculated using the derived set are in good agreement with experimental value over a wide range of E/N values (ratio of the electric field E to the neutral number density N). The present electron collision cross section set for the TRIES molecule, therefore, is the most reliable so far for plasma discharges and for materials processing using the TRIES molecule. Moreover, the electron transport coefficients for the TRIES-Ar and the $TRIES-O_2$ mixtures were also calculated and analyzed over a wide range of E/N for the first time.