• Bulletin of the Korean Chemical Society
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• 제34권8호
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• pp.2276-2280
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• 2013

The accurate prediction of vertical excitation energies is very important for the development of new materials in the dye and pigment industry. A time-dependent density functional theory (TD-DFT) approach coupled with 22 different exchange-correlation functionals was used for the prediction of vertical excitation energies in the halogenated copper phthalocyanine molecules in order to find the most appropriate functional and to determine the accuracy of the prediction of the absorption wavelength and observed spectral shifts. Among the tested functional, B3LYP functional provides much more accurate vertical excitation energies and UV-vis spectra. Our results clearly provide a benchmark calibration of the TD-DFT method for phthalocyanine based dyes and pigments used in industry.

• 대한전기학회:학술대회논문집
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• 대한전기학회 2003년도 하계학술대회 논문집 D
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• pp.2678-2680
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• 2003

본 논문에서는 sliding-DFT의 순환구현을 기반한 실시간 위상 측정 앨고리즘을 제시하였다. 종래의 순환형 SDFT 기반 위상 측정 기법은 단일 계수를 사용하기 때문에 계수 근사가 적용되는 하드웨어 구현시 심각한 오차 파급 특성을 나타낸다. 본 논문에서는 순환 구조이면서 회전 위상을 보정을 통해 N-point DFT의 N개의 모든 계수를 적용한 위상 측정 기법을 제시하였고, FPGA 등 하드웨어 구현에 있어서 계수의 유한 비트 근사에 따르는 성능 열화를 해석하였다. 제안한 위상측정 앨고리즘은 실시간 다채널 위상 측정이 가능하도록 FPGA에 구현하였고 동작을 확인하였다.

• 방송공학회논문지
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• 제16권5호
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• pp.782-792
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• 2011

In this paper, we address a new fast DCT-II/DFT/HWT hybrid transform architecture for digital video and fusion mobile handsets based on Jacket-like sparse matrix decomposition. This fast hybrid architecture is consist of source coding standard as MPEG-4, JPEG 2000 and digital filtering discrete Fourier transform, and has two operations: one is block-wise inverse Jacket matrix (BIJM) for DCT-II, and the other is element-wise inverse Jacket matrix (EIJM) for DFT/HWT. They have similar recursive computational fashion, which mean all of them can be decomposed to Kronecker products of an identity Hadamard matrix and a successively lower order sparse matrix. Based on this trait, we can develop a single chip of fast hybrid algorithm architecture for intelligent mobile handsets.

• 전기학회논문지P
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• 제57권2호
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• pp.91-95
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• 2008

The large AC generator fault may lead to large impacts or perturbations in power system. The generator protection control systems in Korea have been imported and operated through a turn-key from overseas entirely. Therefore a study of the generator protection field has in urgent need for a stable operation of the imported goods. In present, the algorithm using the current ratio differential relaying based DFT for stator winding protection or a fault detection had been applied that of internal fault protection of a generator. the DFT used for the analysis of transient state signal conventionally had defects losing a time information in the course of transforming a target signal to frequency domain. In this paper, the discrete wavelet transform (DWT) was applied a fault detection of the generator being superior to a transient state signal analysis and being easy to real time realization. The fault signals after executing a terminal fault modeling collect using a MATLAB package, and calculate the wavelet coefficients through the process of a muiti-level decomposition (MLD). The proposed algorithm for a fault detection using the Daubechies WT (wavelet transform) was executed with a C language and the commend line function for the real time realization after analyzing MATLAB's graphical interface. The advanced technique had improved faster a speed of fault discrimination than a conventional DFR based on DFT.

• 한국정보통신학회논문지
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• 제14권5호
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• pp.1078-1084
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• 2010

본 논문에서는 오차역전파알고리즘에 의한 신경회로망을 사용하여 이산푸리에변환에 의한 진폭성분과 위상 성분을 복원하는 음성강조 시스템을 제안한다. 먼저, 신경회로망이 잡음이 부가된 음성신호의 이산푸리에변환의 진폭성분과 위상성분을 사용하여 학습된 후, 제안한 시스템은 백색잡음에 의하여 열화된 잡음이 부가된 음성 신호를 강조한다. 백색잡음에 의하여 열화된 음성신호는 이산푸리에변환에 의한 진폭성분과 위상성분을 입력으로 하는 신경회로망을 사용하여 제안된 시스템에 의하여 강조되는 것을 실험결과로 증명한다. 제안한 시스템은 스펙트럼 왜곡율의 평가법을 사용하여 백색잡음에 의하여 열화된 음성신호에 대하여 효과적인 것을 실험으로 확인한다.

• 한국재료학회지
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• 제33권6호
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• pp.236-241
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• 2023

Solar cells based on p-conjugated donor-acceptor (D-A) organic molecular systems are a promising alternative to conventional electrical energy generation. D-A molecular systems, which have a triphenylamine (TPA) moiety linked with a benzothiadiazole (BTD) moiety, open the potential development of new small molecule donors for bulk heterojunction (BHJ) solar cells. Here, a series of donor-acceptor-π-acceptor (D-A-π-A) small molecule donors (SMD) derived from triphenylamine (TPA) donor and benzothiadiazole (BTD) acceptor building blocks, were designed for BHJ organic solar cells. The small molecule donors SMD1-4 were studied using density functional theory (DFT) and time dependent-DFT (TDDFT) methods, to understand the effect of cyano and fluorine group functionalization on their properties. The effect of structure alteration by cyano and fluorine group functionalization on the optoelectronic properties, the calculated highest occupied molecular orbitals (HOMOs) and lowest unoccupied molecular orbitals (LUMOs) and the HOMO-LUMO gaps were theoretically explored. The V_oc (open-circuit photovoltage) and fill factor (FF) for SMD1-4 were obtained with a PC₇₁BM acceptor, which showed that these organic small molecules are potential small molecule donors for organic bulk heterojunction solar cells.

• 한국세라믹학회지
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• 제53권2호
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• pp.184-193
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• 2016

This review deals with computational treatments of subatomic levels of matter based on density functional theory (DFT), and tries to identify several current trends, which are largely consequences of the ever-increasing power of computers, which has substantially extended the performance of conventional DFT beyond its original scope. This review mainly focuses on the conceptual outline, rather than on lines of equations, highlighting several examples of calculations for each topic. It should be noted that these issues are hardly new to leading groups in the field, but certainly are for materials people in general. It should also be noted that the on-going efforts will continue and lead to a larger system size, a longer time scale, a higher accuracy, and a better efficiency of calculation for years to come.

• 전기학회논문지P
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• 제57권4호
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• pp.377-382
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• 2008

For stator winding protection of AC generator, KCL(Kirchhoff's Current Law) is widely applied. Actually a CRDR(Current Ratio Differential Relay) based on DFT(Discrete Fourier Transform) has been used for protecting generator. It has been pointed out that defects can occur during the process of transforming a time domain signal into a frequency domain one which can lead to loss of time domain information. Wavelets techniques are proposed for the analysis of power system transients. This paper introduces an algorithm to choose a suitable Mother Wave1et for generator stator fault detection. For optimal selection, we analyzed db(Daubechies), sym(Symlets), and coif(Coiflects) of Mother Wavelet. And we compared with performance of the choice algorithm using detail coefficients energy and RMS(root mean square) error. It can be improved the reliability of the conventional DFT based CRDR. The feasibility and effectiveness of the proposed scheme is proved with simulation using collected data obtained from ATP (Alternative Transient Program) package.

• 대한전기학회:학술대회논문집
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• 대한전기학회 2007년도 추계학술대회 논문집 전력기술부문
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• pp.75-77
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• 2007

Current percentage differential relaying has been recognized as the principal basis of main protection for stator windings of AC generator. The DWT has merit of obtaining frequency characteristics in time domain. In order to compensate for DFT's defects, we proposed fault detection algorithm using DWT. This paper describes a comparative analysis about conventional DFT-based DFR and advanced DWT-based relaying.

• Nuclear Engineering and Technology
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• 제40권5호
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• pp.365-374
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• 2008

Dependability-critical systems, such as digital instrumentation and control systems in nuclear power plants, necessitate engineering techniques and tools to provide assurances of their safety and reliability. Determining system reliability at the architectural design phase is important since it may guide design decisions and provide crucial information for trade-off analysis and estimating system cost. Despite this, reliability and system engineering remain separate disciplines and engineering processes by which the dependability analysis results may not represent the designed system. In this article we provide an overview and application of our approach to build architecture-based, dynamic system models for dependability-critical systems and then automatically generate dynamic fault trees (DFT) for comprehensive, tool-supported reliability analysis. Specifically, we use the Architectural Analysis and Design Language (AADL) to model the structural, behavioral and failure aspects of the system in a composite architecture model. From the AADL model, we seek to derive the DFT(s) and use Galileo's automated reliability analyses to estimate system reliability. This approach alleviates the dependability engineering - systems engineering knowledge expertise gap, integrates the dependability and system engineering design and development processes and enables a more formal, automated and consistent DFT construction. We illustrate this work using an example based on a dynamic digital feed-water control system for a nuclear reactor.