• 전기화학회지
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• 제5권2호
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• pp.86-92
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• 2002

속도론적 관점에서 키네틱 몬테 카를로 방법의 전기화학적 리튬 인터칼레이션에로의 응용에 대하여 다루었다. 우선 키네틱 몬테 카를로 방법과 전이상태이론의 기본 개념을 소개하였고, 확산거동을 평가하기 위한 시뮬레이션 과정을 설명하였다. 마지막으로 인터칼레이션 화합물중 $LiMn_2O_4$전극에 대해 전류 추이곡선과 선형 포텐셜 전류곡선을 해석하기 위해서 전이상태이론에 근거한 키네틱 몬테 카를로 방법을 셀-저항 제어조건하에서 사용하였다. 이로부터 키네틱 몬테 카를로 방법이 전기화학분야에서 리튬 인터칼레이션의 속도론적 연구에 매우 유용함을 알 수 있었다.

• Journal of Electrochemical Science and Technology
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• 제7권4호
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• pp.251-262
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• 2016

The corrosion protection of mild steel in 1M HCl and 0.5M $H_2SO_4$ solutions by ethanol extract of Vernonia amygdalina (VA) was studied using a combination of experimental and computational methods. The obtained results revealed that VA reduced the corrosion of mild steel in both environments and inhibition efficiency increased with VA concentration but decreased with prolonged exposure. Electrochemical results showed that the extract functioned via mixed corrosion inhibiting mechanism by adsorption of some organic constituents of the extract on the metal/acid interface. Findings from infrared spectroscopy and electron microscopy all confirmed that VA retarded mild steel corrosion in both 1M HCl and 0.5M $H_2SO_4$ through an adsorption process. The adsorption behavior of selected constituents of the extract was modeled using density functional theory computations.

• 전기화학회지
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• 제17권2호
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• pp.119-123
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• 2014

Here I report on how Fourier Transform Electrochemical Impedance Spectroscopy (FTEIS) overcomes the potential-current linearity problem encountered in the impedance calculation process. FTEIS was first invented to solve the time-related drawback of the conventional impedance technique. The dramatic time reduction of FTEIS enabled the real-time impedance measurement but brought about the linearity problem at the same time. While the conventional method circumvents the problem using the steady-state made by a sufficiently long measurement time, FTEIS cannot because of its real-time function. However, according to the mathematical development reported in this article, the potential step used in FTEIS is proved to avoid the linearity problem. During the step period, the potential and the current are linearized by the electrochemical impedance. Also, Fourier transform of the differentiated potential and current is proved to give the same result of the original ones.

• 자원리싸이클링
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• 제10권1호
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• pp.42-48
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• 2001

The dissolution behavior of gold and silver from gold-silver alloys in aerated cyanide solutions has been investigated by an electrochemical means as well as a direct measurement of gold and silver ions reported in the bulk solution as a function of time using rotating disc electrodes. The variables studied included oxygen partial pressure, rotating speed of the disc, concentration of cyanide, temperature and composition of the allyos. The dissolution potential and the rate of dissolution were obtained in view of the anodic and cathodic current-potential relationships. The results were discussed in terms of the mixed potential theory. The results showed that the dissolution rate of gold and silver from the alloys was controlled partially by chemical reaction. but largely by transport of either oxygen or cyanide, depending on their relative concentration under the experimental conditions employed in this study.

• Journal of Electrochemical Science and Technology
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• 제6권4호
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• pp.146-151
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• 2015

Here I report an electrochemical simulation work that compares voltammetric current and resistance of a complex electrochemical reaction over a potential scan. For this work, the finite element method is employed which are frequently used for voltammetry but rarely for impedance spectroscopy. Specifically, this method is used for simulation of a complex reaction where a heterogeneous faradaic reaction is followed by a homogeneous chemical reaction. By tracing the current and its polarization resistance, I learn that their relationship can be explained in terms of rate constants of charge transfer and chemical change. An unexpected observation is that even though the resistance is increased by the rate of the following chemical reaction, the current can be increased due to the potential shift of the resistance made by the proceeding faradaic reaction. This report envisions a possibility of the FEM-based resistance simulation to be applied to understand a complex electrochemical reaction. Until now, resistance simulations are mostly based on equivalent circuits or complete mathematical equations and have limitations to find proper models. However, this method is based on the first-principles, and is expected to be complementary to the other simulation methods.

• 전기화학회지
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• 제4권3호
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• pp.87-93
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• 2001

외부 Ag/AgCl 기준 전극은 가압형 및 비등형 경수로 환경에 널리 사용되었다. 전극의 채움 용액 (Siting solution)으로 통상 KCl을 사용하는데, 다공성 지르코니아로 만들어지는 플러그를 통한 Cl 이온의 누설이 전극의 전위차 변동을 유발하는 문제가 있다. 누설로 인한 전위차 변동의 문제를 해결하기 위해 채움 용액으로 순수를 사용하였다 순수를 사용하는 경우 상온에서의 AgCl용해도에 의해 Cl이온의 농도가 결정된다. 붕산과 수산화리튬 혼합용액으로 $288^{\circ}C$에서 전극의 안정성 실험을 실시하였다. 약 일주일간 전위차 변화는 10mV 이내였으며, $288^{\circ}C$와 $240^{\circ}C$에서의 온도 사이클링 시험 전후의 전위차 변화는 15mV 이내였다. 이온의 limiting equivalent conductances와 Agar의 수역학적 이론을 토대로 하여 전극의 TLJP을 계산하였다. 전극 채움 용액 내의 Cl이온 농도를 상온에서 측정한 값으로 보정하여 이론값을 계산할 경우, 실험값과 비교적 잘 일치하는 것을 알 수 있었다.