• Bulletin of the Korean Chemical Society
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• 제7권3호
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• pp.194-196
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• 1986

The effect of the non-Coulombic long-range forces and the next nearest neighbor interactions on the lattice properties of alkali halide crystals is calculated using the Electron Gas model and Electron Gas Drude model. It is found that these often neglected interactions make changes in the lattice properties that are indeed small, but by no means negligible.

• 전자공학회논문지D
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• 제35D권8호
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• pp.31-37
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• 1998

A new self-consistent hole mobility model that includes lattice and hole temeprature has been proposed. By including the lattice and hole temperatures as well as the effective transverse field and the interface fixed charge, the model predicted the saturation of hole drift velocity and showed the effects of coulomb scattering, surface phonon scattering, and surface roughness scattering. The calculated data by the model were compared with the reported experimental data and they were shown to agree quite well. The new model is expected to estimate the characteristics of very short channel devices in the in the hydrodynamic model simulation.

• 한국마린엔지니어링학회:학술대회논문집
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• 한국마린엔지니어링학회 2006년도 전기학술대회논문집
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• pp.269-270
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• 2006

A finite difference lattice Boltzmann model which allows us to simulate gas-liquid two-phase flows with large density difference, for instance, 800 times for air and water is considered. Two-particle model is used and the density difference is introduced by changing the acceleration according to the fluid density. Numerical measurement of surface tension agrees well with theoretical predictions. Simulations of two-phase phenomenon for phase-transition is carried out, showing applicability of the model for two-phase flows. The two-dimensional cavitating flow around a board set up in the fluid way is also simulated. As a result, it was confirmed that the FDLB method with two-particle model was effective in numerical simulation of cavitating flow and the bubble periodically grew up at the low pressure area behind the board, in which the fluid condition was influenced by the cavitation number.

• 비파괴검사학회지
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• 제26권1호
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• pp.30-39
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• 2006

Feasibility is studied for an application of the mass-spring lattice model (MSLM), a numerical model previously developed for unidirectional composites, to the numerical simulation of ultrasonic inspection of austenitic welds modeled as transversely isotropic. Fundamental wave processes, such as propagation, reflection, refraction, and diffraction of ultrasonic waves in such an inspection are simulated using the MSLM. All numerical results show excellent agreement with the analytical results. Further, a simplified model of austenitic weld inspection has been successfully simulated using the MSLM. In conclusion, a great potential of the MSLM in numerically simulating ultrasonic inspections of austenitic welds has been manifested in this work, though significant further efforts will be required to develop a model with field practicality.

• 한국전산구조공학회:학술대회논문집
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• 한국전산구조공학회 2007년도 정기 학술대회 논문집
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• pp.411-414
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• 2007

The confinement-shear lattice(CSL) model for hardened concretes developed by Cusatis is extended for early age concretes. The uniaxial behaviors available in the literature for 3 to 28 days were simulated by the CSL model to identify the change of the model parameters for various ages. The change with respect to the age was interpolated based on the chemomechanics to develop the extended version of CSL model.

• 한국전산유체공학회:학술대회논문집
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• 한국전산유체공학회 2004년도 춘계 학술대회논문집
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• pp.113-118
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• 2004

This paper presents a two-dimensional edge tone to predict the frequency characteristics of the discrete oscillations of a jet-edge feedback cycle by the finite difference lattice Boltzmann method (FDLBM). We use a new lattice BGK compressible fluid model that has an additional term and allow larger time increment comparing the conventional FDLBM, and also use a boundary fitted coordinates. The jet is chosen long enough in order to guarantee the parabolic velocity profile of the jet at the outlet, and the edge consists of a wedge with an angle of $\alpha=23^0$. At a stand-off distance $\omega$, the edge is inserted along the centreline of the jet, and a sinuous instability wave with real frequency f is assumed to be created in the vicinity of the nozzle and th propagate towards the downstream. We have succeeded in capturing very small pressure fluctuations result from periodically oscillation of jet around the edge. That pressure fluctuations propagate with the sound speed. Its interaction with the wedge produces an irrotational feedback field which, near the nozzle exit, is a periodic transverse flow producing the singularities at the nozzle lips. The lattice BGK model for compressible fluids is shown to be one of powerful tool for computing sound generation and propagation for a wide range of flows.

• 한국전산유체공학회지
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• 제15권2호
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• pp.21-27
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• 2010

Immersed boundary lattice Boltzmann method (IBLBM) has been applied to simulate a turbulent flow over circular cylinder in a flow field effectively. Although IBLBM is very effective method to simulate the flow over a complex shape of obstacle in the flow field regardless of the constructed grids in the calculation domain, the results, however, become numerically unstable in high reynolds number flow. The most effective suggestion to archive the numerical stability in high Reynolds number flow is applying the multiple relaxation time (MRT) model instead of single relaxation time(SRT) model in the collision term of lattice Boltzmann equation. In the research MRT model for IBLBM was introduced and comparing the numerical results obtained by applying SRT and MRT. The hydraulic characteristic of cylinder in a flow field between two parallel plate at the range of $Re{\leqq}2000$represented and it is also compared the drag and lifting coefficients of the cylinder calculated by IBLBM with SRT and MRT model.

• 한국안전학회지
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• 제7권2호
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• pp.71-79
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• 1992

This paper presents a least-square algorithms of lattice structures and their use for adaptive prediction of time series generated from the dynamic system. As the view point of adaptive prediction, a new method of Identification of dynamic characteristics by means of estimating the parameters of linear auto regressive model is proposed. The fast convergence of adaptive lattice algorithms is seen to be due to the orthogonalization and decoupling properties of the lattice. The superiority of the least-square lattice is verified by computer simulation, then predictor coefficients are computed from the linear sequential time data. For the application to the dynamic characteristic analysis of unknown system, the transfer function of ideal system represented in frquency domain and the estimated one obtained by predicted coefficients are compared. Using the proposed method, the damping ratio and the natural frequency of a dynamic structure subjected to random excitations can be estimated. It is expected that this method will be widely applicable to other technical dynamic problem in which estimation of damping ratio and fundamental vibration modes are required.

• 한국세라믹학회지
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• 제33권7호
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• pp.802-808
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• 1996

PbTiO3 thin films were fabricated onto MgO(100) single crystal substrate by reactive D. C magnetron sput-tering of Pb and Ti metal in an oxygen and argon gas mixture. The annealing of the thin films resulted in the decrease of both the c-axis orientation ratio and the lattice parameter. It is well known that the c-axis lattice parameter of thin film is dependent on the Pb/(Pb+Ti)ratio and the residual stress in the film The PbTiO3 thin films with a Pb/(Pb+T) ratio ranging from 0.45 to 0.57 were fabricated and annealed. The structure of the film the c-axis orientation ratio and the lattice parameter were not dependent on the Pb/(Pb+Ti) ratio before and after annealing. These experimental results proved that the decrease of the c-axis lattice parameter under the annealing conditions was due to the relaxation of the intrinsic stress in the film. This relaxation of the intrinsic stress caused the decrease of the c-axis orientation ratio and this phenomenon can be explained by c-axis growth lattice model.

• Bulletin of the Korean Chemical Society
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• 제33권3호
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• pp.980-986
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• 2012

In this paper we develop a minimalist model of single molecule spectroscopy in a dynamic environment. Our model is based upon a lattice system consisting of a probe molecule embedded in an Ising-model like environment. We assume that the probe molecule interacts with the Ising spins via a dipole-dipole potential, and calculate free energy curves and lineshapes of the system. To investigate fluctuation behavior of the system we exploit the metadynamics sampling method. In particular, using the method, we calculate the free energy curve of magnetization of the lattice and that of the transition energy of the probe molecule. Furthermore, we compare efficiencies of three different sampling methods used; unbiased, umbrella, and metadynamics sampling methods. Finally, we explore the lineshape behavior of the probe molecule as the system undergoes a phase transition from a sub-critical and to a super-critical temperature. We show that the transition energy of a probe molecule is broadly distributed due to the heterogeneous, local environments.