• ETRI Journal
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• v.37 no.1
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• pp.43-53
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• 2015

In this paper, a selective coefficient updating (SCU) approach at each branch of the per-tone equalization (PTEQ) structure has been applied for insufficient cyclic prefix (CP) length. Because of the high number of adaptive filters and their complex adaption process in the PTEQ structure, SCU has been proposed. Using this method leads to a reduction in the computational complexity, while the performance remains almost unchanged. Moreover, the use of set-membership filtering with variable step size is proposed for a sufficient CP case to increase convergence speed and decrease the average number of calculations. Simulation results show that despite the aforementioned algorithms having similar performance in comparison with conventional algorithms, they are able to reduce the number of calculations necessary. In addition, compensation of both the channel effect and the transmitter/receiver in-phase/quadrature-phase imbalances are achievable by these algorithms.

• 한국전산유체공학회:학술대회논문집
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• 2009.11a
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• pp.77-83
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• 2009

In this study, we conducted resistance and propulsion performance test of ship composed of the Resistance Test, Propeller Open Water Test and Self Propulsion Test using the CFD(Computational Fluid Dynamics). We used commercial RANS(Reynolds Averaged Navier Stokes equation) solver, as a calculating tool. The unstructured grids were used in a bow and stern of ship, having complex shape, for a convenience of generating grids, and the structured grids were adopted in a central hull and rest of hull having a relatively simple shape which is called hybrid grid method. In addition, The sliding mesh method was adopted to rotate a propeller directly in the Propeller Open Water and Self Propulsion Test. The Resistance Test and Self Propulsion Test were calculated using Volume of Fluid (VOF) model and considering a free surface. And all The three cases were applied realizable k-epsilon model as the turbulence model. The results of calculations were verified for the suitability of calculations by comparing MOERI's EFD results.

• Proceeding of EDISON Challenge
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• 2017.03a
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• pp.457-462
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• 2017

A linear carbon chain with pure sp hybridization has been intensively studied for the application of its intrinsic electrical properties to electronic devices. Owing to the high chemical reactivity derived from its unsaturated bond, encapsulation by carbon nanotubes (CNT) is provided as a promising method to stabilize the geometry of the linear carbon chain. Although the influence of CNT on the carbon chain has extensively been studied in terms of both electronic structure and geometries, the electron transport properties has not been discussed yet. In this regard, we provide the systematic atomic-scale analyses of the properties of the linear carbon chain within CNT based on a computational approach combining density-functional theory (DFT) and matrix green function (MGF) method. Based on the DFT calculations, the influence of CNT on electronic structures of the linear carbon chain is provided as well as its electrical origin. Via MGF calculations, we also identify the electron transport properties of the carbon chain - CNT complex.

• Bulletin of the Korean Chemical Society
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• v.32 no.10
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• pp.3614-3617
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• 2011

A density functional theory method with the local basis set was employed to perform slab calculations to study thiolate-induced surface reconstruction structures of butylthiolates (ButS) with c($4{\times}2$) superlattice of the Au(111) surface. The slab calculations indicate that the most stable adsorption structure is the ButS-Au (adatom)-SBut complex form, which is in good agreement with the reported experiments and theoretical results for thiolates with shorter alkyl chains. The cis form of ButS-Au (adatom)-SBut motifs is preferred by 0.11 eV with respect to the trans form, and by 0.15 eV over the mixed cis-trans configurations due to the steric hindrance between adjacent butyl groups. It appears that the motif of Au adatom on the Au(111) surface is favored even for butylthiolate.

• 한국전산유체공학회:학술대회논문집
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• 1999.05a
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• pp.66-72
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• 1999

A numerical simulation method has been under development for solving turbulent flows around a ship model in maneuvering motion using the Reynolds Averaged Navier-Stokes equations. The method used second-order finite differences, collocated grids, pressure-Poisson equation and four-stage Runge-Kutta scheme as key components of the solution method. A modified Baldwin-Lomax model is used for the turbulence closure. This paper presents a preliminary result of the computational study on turbulent flows past a ship model in drift motion. Calculations are carried out for a Series 60 $C_B=0.6$ ship model, for which detailed experimental data are available. The results of the present calculations are compared with the experimental data for hydrodynamic forces acting on the model as well as velocity distributions at longitudinal sections. Only fair agreements has been achieved. The computational results show the complex asymmetrical shear flow patterns including three-dimensional separations followed by formation of bilge vortices both in bow and stern regions.

• Proceedings of the KIEE Conference
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• 1996.11a
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• pp.179-181
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• 1996

In conventional hydrothermal coordination problem, the lambda-gamma iteration method is generally used for generation schedule. The procedure of classical lambda-gamma iteration method consists of 3 main loops and it is very complex. Therefore, it needs many iterative calculations. This paper proposes an advanced hydrothermal algorithm based on newly developed lambda-gamma iteration method. As lambda calculation loop is removed in the newly developed iteration method, iterative calculations are reduced and whole procedure is simplified. The proposed algorithm is verified on simple system.

• Bulletin of the Korean Chemical Society
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• v.9 no.3
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• pp.117-121
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• 1988

The molecular interaction and geometrical optimization of Cr$(CO)_5\;and\;Ni(CO)_3$ units have been studied for phosphinidene complex by means of extended Huckel calculations. The results were compared with those of ab initio calculations and found to be in qualitative agreement. Geometrical optimization of HPCr$(CO)_5\;(1)\;and\;HPNi(CO)_3$ (2) gave the values R = 2.36 ${\AA}$, ${\theta}$ = $111.5^{\circ}$, and ${\phi}$ = $45^{\circ}$for 1, and R = 2.37 ${\AA}$, ${\theta}$= $120^{\circ}$, and ${\phi}$ = $58^{\circ}$for 2. It is found that the low rotational barriers for 1(0.46 kcal $mol^{-1}$) and 2(0.12 kcal $mol^{-1}$) would be accompanied by the free rotation, in spite of the fact that both 1 and 2 adopt staggered conformations.

• Bulletin of the Korean Chemical Society
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• v.9 no.3
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• pp.121-126
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• 1988

The molecular interaction of $Mo_2(OR)_4({\mu}-OR)_2$$ unit has been studied for carbonyl and acetylene ligands by means of extended Huckel calculations. We have extended the extended Hckel calculations to unknown apex bridged $Mo_2(OR)_6({\mu}-X)$ complexes (X = $SO_2$H, and Cl) in order to compare the stability of the complexes. In the $C_2H_2$and H apex bridged complexes, one finds a relatively small HOMO-LUMO gap. However, both complexes are stabilized due to Jahn-Teller distortion. The stability of both complexes is comparable to that of $Mo_2(OR)_6(CO)$ complex. The comparisons and predictions in the stability of known and unknown complexes are the subject of this study.

• Bulletin of the Korean Chemical Society
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• v.22 no.7
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• pp.693-698
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• 2001

Ab initio density functional calculations on the structural isomers, the hydration energies, and the hydrogen bond many-body interactions for gauche-, trans-protonated ethylenediamine-(water)3 complexes (g-enH+(H2O)3, t-enH+(H2O)3) have been performed. The structures and relative stabilities of three representative isomers (cyclic, tripod, open) between g-enH+(H2O)3 and t-enH+(H2O)3 are predicted to be quite different due to the strong interference between intramolecular hydrogen bonding and water hydrogen bond networks in g-enH+(H2O)3. Many-body analyses revealed that the combined repulsive relaxation energy and repulsive nonadditive interactions for the mono-cyclic tripod isomer, not the hydrogen bond cooperativity, are mainly responsible for the greater stability of the bi-cyclic isomer.

• Nuclear Engineering and Technology
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• v.54 no.5
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• pp.1902-1908
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• 2022

In many of the complex systems modeled in the field of nuclear engineering, it is often useful to use linear regression-based analyses to analyze relationships between model parameters and responses of interests. In cases where the response of interest is calculated by a simulation which uses Monte Carlo methods, there will be some uncertainty in the responses. Further, the reduction of this uncertainty increases the time necessary to run each calculation. This paper presents some discussion on how the Monte Carlo error in the response of interest influences the error in computed linear regression coefficients. A mathematical justification is given that shows that when performing linear regression in these scenarios, the error in regression coefficients can be largely independent of the Monte Carlo error in each individual calculation. This condition is only true if the total number of calculations are scaled to have a constant total time, or amount of work, for all calculations. An application with a simple pin cell model is used to demonstrate these observations in a practical problem.