• 대한화학회지
• /
• 제53권2호
• /
• pp.99-110
• /
• 2009

본 총설에서는 유리 전이에 관계되는 상태인 과냉각 액체와 유리의 특성, 그리고 유리 전이 관련 이론에 살펴보았다. 이 상태들은 비평형 상태로, 유리 전이는 일반적인 상전이와는 다르다. 유리와 관련 실 험 방법에 관하여 간략히 요약하였다.

• Bulletin of the Korean Chemical Society
• /
• 제30권12호
• /
• pp.2973-2978
• /
• 2009

The decomposition reaction mechanism of $CH_3CF_2O$ radical formed from hydroflurocarbon, $CH_3CHF_2$ (HFC-152a) in the atmosphere has been investigated using ab-initio quantum mechanical methods. The geometries of the reactant, products and transition states involved in the decomposition pathways have been optimized and characterized at DFT-B3LYP and MP2 levels of theories using 6-311++G(d,p) basis set. Calculations have been carried out to observe the effect of basis sets on the optimized geometries of species involved. Single point energy calculations have been performed at QCISD(T) and CCSD(T) level of theories. Out of the two prominent decomposition channels considered viz., C-C bond scission and F-elimination, C-C bond scission is found to be the dominant path involving a barrier height of 12.3 kcal/mol whereas the F-elimination path involves that of a 28.0 kcal/mol. Using transition-state theory, rate constant for the most dominant decomposition pathway viz., C-C bond scission is calculated at 298 K and found to be 1.3 ${\times}$ 10$^4s{-1}$. Transition states are searched on the potential energy surfaces involving both decomposition channels and each of the transition states are characterized. The existence of transition states on the corresponding potential energy surface are ascertained by performing Intrinsic Reaction Coordinate (IRC) calculation.

• 대한전자공학회논문지SD
• /
• 제42권10호
• /
• pp.47-54
• /
• 2005

본 논문에서는 불완전명세(incompletely-specified)를 가진 상태전이그래프(state transition graph: STG)상에서 리던던트 고장(redundant faults)수를 줄여 테스트를 용이하게 하기 위한 새로운 동기 순차회로의 합성방법을 제안한다. 이 STG 합성법에는 1) 구별전이(distinguishable transition)을 이용하여 무정의상태(undefined states)와 불완전명세된 입력전이를 추가하고, 2) 가능한 한 강연결(strongly-connected)이 되도록 하는 방법을 사용한다. 제안된 방법을 이용하여 MCNC 벤치마크 회로에 대해 실험한 결과, 대부분의 회로에 대해 무해 고장의 수가 현격히 줄어들어 높은 고장검출을 얻었다.

• 대한전자공학회:학술대회논문집
• /
• 대한전자공학회 2000년도 ITC-CSCC -1
• /
• pp.355-358
• /
• 2000

In this paper we propose procedures to enhance testability by modifying state transition tables. In these procedures, transitions about undefined states, which are not described in state transition tables but exist in a synthesized gate level circuit, are added to a state transition table. Experimental results for MCNC benchmarks are shown.

• Bulletin of the Korean Chemical Society
• /
• 제20권11호
• /
• pp.1281-1287
• /
• 1999

The low-lying electronic states of diazirine and 3,3'-dimethyldiazirine have been studied by high level ab initio quantum chemical methods. The equilibrium geometries of the ground state and the first excited singlet and triplet states have been optimized using the Hartree-Fock (HF) and complete active space SCF (CASSCF) methods, as well as using the Møller-Plesset second order perturbation (MP2) theory and the single configuration interaction (CIS) theory. It was found that the first excited singlet state is of 1 B1 symmetry resulting from the n- π* transition, while the first excited triplet state is of 3 B2 symmetry resulting from the π- π* transition. The harmonic vibrational frequencies have been calculated at the optimized geometry of each electronic state, and the scaled frequencies have been compared with the experimental frequencies available. The adiabatic and vertical transition energies from the ground electronic state to the low-lying electronic states have been estimated by means of multireference methods based on the CASSCF wavefunctions, i.e., the multiconfigurational quasidegenerate second order perturbation (MCQDPT2) theory and the CASSCF second-order configuration interaction (CASSCF-SOCI) theory. The vertical transition energies have also been calculated by the CIS method for comparison. The computed transition energies, particularly by MCQDPT2, agree well with the experimental observations, and the electronic structures of the molecules have been discussed, particularly in light of the controversy over the existence of the so-called second electronic state.

• 대한전자공학회논문지
• /
• 제12권2호
• /
• pp.24-27
• /
• 1975

Transition-Sensitive Flip-Flops(TSFF)에 의하여 원시흐름표로 부터 다입력변화 비동기순서논리회로를 합성하는 하나의 방법을 제안하였다. 목 방법에 의해시 실현한 회로는 Chuang의 그것보다 속도가 빠르다. Chuang의 출력상태를 실현하는 방법은 오진를 범하고 있음을 지적하고 원시흐름표로 부터 출력상태를 제어 여거법에 의해서 간편하게 실현할 수 있음을 보였다.

• Asian Journal of Innovation and Policy
• /
• 제11권3호
• /
• pp.293-319
• /
• 2022

By analyzing the adaptive capacity, market formation and policy direction as functional areas of Technological Innovation System (TIS), the article evaluates the progress of renewable energy transition in the Maldives, with the inclusion of ideas from Mauritius and Cabo Verde. On the policy direction in the Maldives, technology roadmaps produced with assistance from International Renewable Energy Agency (IRENA) and Asian Development Bank (ADB) are evaluated. Although there are inducing factors such as the Solar Risk Management Initiative, the progress of energy transition is hindered by the lack of technical capacity and local value chain. The findings indicate the importance of facilitating and establishing industry and knowledge networks, incorporating innovation policies, greater involvement of the local private sector along with international investors, and taking water-energy nexus to achieve complementary targets. The study adds value to knowledge by offering a simplified TIS framework, with a current insight of the energy transition in Small Island Developing States with a focus on the Maldives.

• Journal of Magnetics
• /
• 제13권1호
• /
• pp.7-10
• /
• 2008

The structural and magnetic properties of functionalized carbon chains doped with 4d transition metals, such as Ru, Rh, and Pd, were investigated using the full-potential linearized augmented plane wave (FLAPW) method. The carbon nanowire doped with Ru exhibited a ferromagnetic ground state with a sizable magnetic moment, while those doped with Rh and Pd had nonmagnetic ground states. For the Ru-doped chain, the density of states at the Fermi level showed large spin polarization, which suggests that the doped nanowire could be used for spintronic applications.

• Bulletin of the Korean Chemical Society
• /
• 제2권2호
• /
• pp.41-45
• /
• 1981

For solvolyses of benzenesulfonylchlorides we determined transfer enthalpies of transition states, and solvent (TFE + EtOH) and substituent effects on rates. We have used the More O'Ferrall plots to show that transition states variation caused by solvent and substituent changes is consistent with an associative $S_N2$ mechanism for the nucleophilic substitution reaction of benzenesulfonylchlorides.

• 한국안전학회지
• /
• 제11권3호
• /
• pp.104-111
• /
• 1996

A system was developed that could predict hazardous states for safe operation of chemical plants. This system aimed to prevent hazards of chemical processes from misoperation before real operation. In this study, a data base was organized which consisted of all hazards in the chemical processes. The structure of process was represented by signed direct graph(SDG) of NODEs and ARCs. Each NODE and ARC have property variables ; connected structure and state of processes etc. The hazards that could be occurred in processes were divided into two classes ; one is by operation of unit and the other is by hazardous materials. Using Hazardous States Transition Network, we could recognize transition progress of process states.