• International Journal of Aeronautical and Space Sciences
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• 제16권3호
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• pp.347-359
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• 2015

A method of describing the rovibrational energy transitions and coupled chemical reactions in the direct simulation Monte Carlo (DSMC) calculations is constructed for $H(^2S)+H_2(X^1{\Sigma}_g)$ and $He(^1S)+H_2(X^1{\Sigma}_g)$. First, the state-specific total cross sections for each rovibrational states are proposed to describe the state-resolved elastic collisions. The state-resolved method is constructed to describe the rotational-vibrational-translational (RVT) energy transitions and coupled chemical reactions by these state-specific total cross sections and the rovibrational state-to-state transition cross sections of bound-bound and bound-free transitions. The RVT energy transitions and coupled chemical reactions are calculated by the state-resolved method in various heat bath conditions without relying on a macroscopic properties and phenomenological models of the DSMC. In nonequilibrium heat bath calculations, the state-resolved method are validated with those of the master equation calculations and the existing shock-tube experimental data. In bound-free transitions, the parameters of the existing chemical reaction models of the DSMC are proposed through the calibrations in the thermochemical nonequilibrium conditions. When the bound-free transition component of the state-resolved method is replaced by the existing chemical reaction models, the same agreement can be obtained except total collision energy model.

• Bulletin of the Korean Chemical Society
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• 제21권5호
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• pp.503-509
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• 2000

The solvent effects on the relative free energies of solvation and the difference in partition coefficients (log P) for $Rb^+$ to $K^+$ mutation in several solvents have been investigated using Monte Carlo simulation (MCS) of statistical perturbation theory(SPT). In comparing the relative free energies for interconversion of one ion pair, $Rb^+$ to $K^+$, in $H_2O$(TIP4P) in this study with the relative free energies of the computer simulations and the experimental, we found that the figure in this study with the relative free energies of the computert simulations and the experimental, we found that the figure in this study is $-5.00\pm0.11$ kcal/mol and those of the computer simulations are $-5.40\pm1.9$, -5.5, and -5.4 kcal/mol. The experimental is -5.1 kcal/mol. There is good agreement among various studies, taking into account both methods used to obtain the hydration free energies and standard deviations. There is also good agreement between the calculated structural properties of this study and the simulations, ab initio and the experimental results. We have explained the deviation of the relationship between the free energy difference and the Onsager dielectric function of solvents by the electron pair donor properties of the solvents. For the $Rb^+$ and $K^+$ ion pair, the Onsager dielectric function of solvents (or solvent permittivity), donor number of solvent and the differences in solvation dominate the differences in the relative free energies of solvation and partition coefficients.

• 한국수소및신에너지학회논문집
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• 제24권6호
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• pp.472-479
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• 2013

A free piston linear engine could be operated under HCCI combustion due to its variable compression ratios. To obtain HCCI combustion, the free piston linear engine needs a high compression ratio to achieve auto-ignition of the fuel/air mixture. In this study, an idea for obtaining a high compression ratio using the transition from SI combustion to HCCI combustion was proposed. The fuel used in this study is hydrogen, which is considered to be an environmentally friendly fuel. Besides, the effects of key parameters such as equivalence ratio (${\phi}$), load resistance ($R_L$) and intake temperature ($T_{in}$) on the SI-HCCI transition were numerically investigated. The simulation results show that the SI-HCCI transition is successful without any significant reduction of in-cylinder pressure as the intake temperature is increased from $T_{in}$=300K (SI mode) to $T_{in}$=450K (HCCI mode), while the load resistance and equivalence ratio are retained respectively at $R_L=120{\Omega}$ and ${\phi}$=0.6 in both SI mode and HCCI mode.

• Interaction and multiscale mechanics
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• 제1권2호
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• pp.303-315
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• 2008

In this paper, thermodynamical properties of crystalline silicon under strain are calculated using classical molecular dynamics (MD) simulations based on the Tersoff interatomic potential. The Helmholtz free energy of the silicon crystal under strain is calculated by using the ensemble method developed by Frenkel and Ladd (1984). To account for quantum corrections under strain in the classical MD simulations, we propose an approach where the quantum corrections to the internal energy and the Helmholtz free energy are obtained by using the corresponding energy deviation between the classical and quantum harmonic oscillators. We calculate the variation of thermodynamic properties with temperature and strain and compare them with results obtained by using the quasi-harmonic model in the reciprocal space.

• 한국원자력학회:학술대회논문집
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• 한국원자력학회 1997년도 춘계학술발표회논문집(1)
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• pp.392-399
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• 1997

An approximation technique was developed for the simulation of free surface flows in non-orthogonal coordinates. The main idea of this approach is to approximate VOF by the second order linear equation in the transformed domain on the assumption that the continuity of free surface would be maintained. The method was justified through a set of numerical test to examine if its original shape could be maintained when the circles are convected in uniform velocity in horizontal direction in curvilinear coordinates. Finally a simple problem was solved by applying the method to CFX4.1 general purpose CFDS code.

• 대한전기학회:학술대회논문집
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• 대한전기학회 2008년도 제39회 하계학술대회
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• pp.1104-1105
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• 2008

This paper presents the assesment of experimented data and estimated data for electrical and thermal performance evaluation of building integrated photovoltaic(BIPV) system of cold facade type. BIPV module is used to estimate the dependence of module temperature on irradiance, ambient temperature and indoor temperature. The module temperature of no free ventilated facade PV system is higher than cold facade PV system about 13.4$^{\circ}C$. By the results on simulation, the reduction of electrical power loss is 9.57% into cold facade according to free ventilation. The annual averaged PR of BIPV system into cold facade is about 73.1%.

• Journal of Power Electronics
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• 제11권3호
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• pp.256-263
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• 2011

This paper utilizes free oscillation and energy injection principles to generate and control the high frequency current in the primary track of a contactless power transfer system. Here the primary power inverter maintains natural resonance while ensuring near constant current magnitude in the primary track as required for multiple independent loads. Such energy injection controllers exhibit low switching frequency and achieve ZCS (Zero Current Switching) by detecting the high frequency current, thus the switching stress, power losses and EMI of the inverter are low. An example full bridge topology is investigated for a contactless power transfer system with multiple pickups. Theoretical analysis, simulation and experimental results show that the proposed system has a fast and smooth start-up transient response. The output track current is fully controllable with a sufficiently good waveform for contactless power transfer applications.

• 한국터널지하공간학회 논문집
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• 제26권5호
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• pp.403-419
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• 2024

터널 발파에서 굴진율은 공사기간과 공사비에 영향을 미치는 중요한 요소이므로 굴진율 증대를 위한 발파공법개발 연구가 계속해서 이루어지고 있다. 본 논문에서는 굴진율 증대를 위한 새로운 발파패턴 개발을 위한 기초자료 확보를 목적으로 2, 3 자유면 발파의 굴진율과 비장약량의 차이를 비교하고자 하였다. 대형 시멘트 모르타르 시험체를 제작하여 2, 3 자유면 발파실험을 수행하고, 실험 결과를 수치해석 결과와 비교하였다. 동일 조건하에서 2자유면 발파보다 3자유면 발파 시 귤진율이 크게 증가하였고, 비장약량은 감소하였다. 본 연구의 결과는 3자유면을 활용한 발파패턴 개발에 활용될 것이며, 이를 통한 터널 및 노천 발파에 있어서의 굴진율 증대 및 천공 수와 화약량 감소 효과를 기대한다.

• 한국정보통신학회논문지
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• 제16권11호
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• pp.2550-2556
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• 2012

본 논문에서는 노드의 위치정보를 측정함에 있어 거리정보에 기반을 두지 않은 방식(range-free)에서의 라우팅 에너지 효율성을 개선한 ALPS(Ad hoc network Localized Positioning System) 알고리즘을 제안한다. 본 논문에서 제안되는 ALPS 알고리즘은 계층적 클러스터 단위에 소속된 임의의 노드에 대한 위치정보를 RSSI(Received signal strength indication)에 의해 상대적 위치정보를 제공하는 방법이다. 제안된 알고리즘에 따른 위치정보를 사용 할 경우 기존의 DV-hop방식에 따른 노드의 평균 위치정보를 사용한 경우보다 계층적 좌표 방식에 의한 제안된 방식이 보다 최적화된 에너지 소모를 유지할 수 있는 경로 알고리즘을 제공하게 된다. 제공된 알고리즘의 성능 분석을 위해 본 논문에서는 상기 두 가지 방식의 위치정보에 따른 라우팅에서 소모되는 에너지 관계를 비교 하였고, 이로부터 보다 최적화된 에너지 경로 관리가 되는 결과를 보여주었다.

• 대한기계학회논문집
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• 제11권6호
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• pp.1026-1035
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• 1987

본 연구에서는 두께방향에 따른 유동을 해석하는데 "fountain effect" 및 열 전달 현상을 동시에 고려하면서 진전하는 자유표면의 형상을 정확히 구하기 위한 유한 요소법을 이용한 수치해석법을 제안하고 그 방법을 적용하여 금형벽의 온도를 변화시 켜가면서 구체적인 유동특성을 해석하였다.특성을 해석하였다.