• Bulletin of the Korean Chemical Society
• /
• 제21권12호
• /
• pp.1239-1244
• /
• 2000

A study of K addition to the catalyst of CoMo/ ${\gamma}-Al_2O_3$ was studied. The catalyst with 10 at% of K to Mo atoms in 3C10M, the catalyst added 3 wt% CoO to 10 wt% $MoO_3/{\gamma}-Al_2O_3$, showed the highest activity for water gas shift reaction. The addition of K retarded the reducibility of cobalt-molybdenum catalysts. It gave, however, good dispersion and large BET surface area to the catalysts which were attributed to the disappearance of polymolybdate clustyer such as $Mo_7O_{24}^{6-}$ and the formation of small Mo$O_4^{2-}$ cluster. It was confirmed by the analyses of pore size distribution, activation energy, Raman spectroscopy, and electron diffraction. The activation energies and the frequency factors of the catalysts 3C10M and 5KC10M (the catalyst added 5 at% K for Mo to the catalyst 3C10M) were 43.1 and 47.8 kJ/mole, and 4,297 and 13,505 $sec^{-1}$, respectively. These values were also well correlated with our suggestion. These phenomena were attributed to the direct interaction between K and CoMo oxides irrelevant to the support.

• 한국추진공학회:학술대회논문집
• /
• 한국추진공학회 2008년 영문 학술대회
• /
• pp.364-370
• /
• 2008

Spinning detonations propagating in a circular tube were numerically investigated with a one-step irreversible reaction model governed by Arrhenius kinetics. The time evolution of the simulation results was utilized to reveal the propagation mechanism of single-headed spinning detonation. The track angle of soot record on the tube wall was numerically reproduced with various levels of activation energy, and the simulated unique angle was the same as that of the previous reports. The maximum pressure histories of the shock front on the tube wall showed stable and unstable pitch modes for the lower and higher activation energies, respectively. The shock front shapes and the pressure profiles on the tube wall clarified the mechanisms of two modes. The maximum pressure history in the stable pitch remained nearly constant, and the single Mach leg existing on the shock front rotated at a constant speed. The high and low frequency pressure oscillations appeared in the unstable pitch due to the generation and decay of complex Mach interaction on the shock front shape. The high frequency oscillation was self-induced because the intensity of the transverse wave was changed during propagation in one cycle. The high frequency behavior was not always the same for each cycle, and therefore the low frequency oscillation was also induced in the pressure history.

• 한국해양공학회지
• /
• 제35권3호
• /
• pp.229-237
• /
• 2021

A numerical hydrodynamic performance analysis of the pitch-type multibody wave energy converter (WEC) is carried out based on both linear potential flow theory and computational fluid dynamics (CFD) in the unidirectional wave condition. In the present study, Salter's duck (rotor) is chosen for the analysis. The basic concept of the WEC rotor, which nods when the pressure-induced motions are in phase, is that it converts the kinetic and potential energies of the wave into rotational mechanical energy with the proper power-take-off system. This energy is converted to useful electric energy. The analysis is carried out using three WEC rotors. A multibody analysis using linear potential flow theory is performed using WAMIT (three-dimensional diffraction/radiation potential analysis program), and a CFD analysis is performed by placing three WEC rotors in a numerical wave tank. In particular, the spacing between the three rotors is set to 0.8, 1, and 1.2 times the rotor width, and the hydrodynamic interaction between adjacent rotors is checked. Finally, it is confirmed that the dynamic performance of the rotors slightly changes, but the difference due to the spacing is not noticeable. In addition, the CFD analysis shows a lateral flow phenomenon that cannot be confirmed by linear potential theory, and it is confirmed that the CFD analysis is necessary for the motion analysis of the rotor.

• Bulletin of the Korean Chemical Society
• /
• 제7권4호
• /
• pp.262-266
• /
• 1986

A multi-reference many-body perturbation theory (MRMBPT) method is critically tested in second order by comparing with the corresponding configuration interaction (CI) calculations. Excitation energies of the four-valence-electron states of transition metal atoms and ions are used for the comparison. The agreement between the second order MRMBPT and CI calculations is very reasonable, confirming the reliability of the second order MRMBPT method. The reliability of calculations with the present second order MRMBPT method was only been inferred empirically in the past since most results have been gauged by the agreement with experiment and/or with other MRMBPT calculations based upon different sets of orbitals and configuration spaces. The present MRMBPT method appears to be an efficient ab initio multi-reference method for the calculation of electron correlation effects in atoms and molecules, and it is shown how MRMBPT can be used to estimate core-core and core-valence correlation effects which are often omitted in CI calculations because too many configurations and correlating electrons are involved.

• Bulletin of the Korean Chemical Society
• /
• 제12권3호
• /
• pp.265-270
• /
• 1991

Theoretical calculations on the stabilization energies of framework atoms in hydrolyses Co(Ⅱ )-exchanged zeolite A were made using some potential energy functions and optimization program. The protons which are produced by hydrolysis of $[Co(H_2O)_n]^{2+}$ ion in large cavity showed a tendency to attack the framework oxygen atom O(1) preferentially, and the oxygen atom O(4) within OH- ion was coordinated at Al atom. The weakness of bonds between T(Si, Al) and oxygen by attack of proton and too large coordination number around small aluminum atom will make the framework of Co(Ⅱ)-exchanged zeolite A more unstable. The stabilization energy of $Co_4Na_4$-A framework (- 361.57 kcal/mol) was less than that of thermally stable zeolite A($Na_{12-}$A: - 419.68 kcal/mol) and greater than that of extremely unstable Ba(Ⅱ)-exchanged zeolite A($Ba_{6-}$A: - 324.01 kcal/mol). All the data of powder X-ray diffraction, infrared and Raman spectroscopy of Co(Ⅱ)-exchanged zeolite A showed the evidence of instability of its framework in agreement with the theoretical calculation. Three different groups of water molecules are found in hydrated Co(Ⅱ )-exchanged zeolite A; W(Ⅰ) group of water molecules having only hydrogen-bonds, W(Ⅱ) group water coordinated to $Na^+$ ion, ans W(Ⅲ) group water coordinated to Co(Ⅱ) ion. The averaged interaction energy of each water group shows the decreasing order of W(Ⅲ)>W(Ⅱ)>W(Ⅰ).

• 한국분무공학회지
• /
• 제27권3호
• /
• pp.134-143
• /
• 2022

When a recess is applied to a swirl coaxial injector that uses liquid and gas propellants, a self-pulsation phenomenon in which the spray oscillates at regular intervals may occur. The phenomenon is caused by the interaction between the liquid and gas propellants inside the injector recess region. The propellants' kinetic energies are expected to affect significantly the spray oscillation. Therefore, cold-flow tests using helium as a gas-simulating propellant were conducted and compared with the results of the previous study using air. Dynamic pressure was measured in the injector manifold and frequency characteristics were investigated through the fast Fourier transform analysis. In the experimental environment, the helium density was about seven times lower than the air density. Accordingly, the intensity of pressure fluctuations was confirmed to be greater when air was used. At the same kinetic energy condition, the perturbation frequency was almost identical in the low flow rate conditions. However, as the flow rate increased, the self-pulsation frequency was higher when helium was used.

• 센서학회지
• /
• 제31권6호
• /
• pp.376-382
• /
• 2022

A triboelectric nanogenerator (TENG) can obtain electrical output due to the reciprocal motion between two objects (i.e., rubbing), in which repetitive contact is made. High reliability, stable output, and high reproducibility are important aspects of the electrical output obtained through a TENG as a sensor or generator, thus enabling its meaningful use. Therefore, many researchers fabricated TENGs into individual parts in the form of one module type to obtain high reproducibility and reliability. Since a TENG manufactured as a module type operates as a single device, it is possible to collect kinetic energy and convert it into electrical energy through the interaction between internally configured elements without the need for a separate structure. In addition, it is relatively easy to apply the size to the body, machine tools, and natural environment by simply adjusting the size suitable for use and surrounding environmental conditions. In this paper, the application cases of module-type TENGs are divided into four areas, and the research progress of module-type TENGs in each area is extensively reviewed.

• 한국건축시공학회:학술대회논문집
• /
• 한국건축시공학회 2023년도 봄 학술논문 발표대회
• /
• pp.255-256
• /
• 2023

The development of corrosion inhibitors with outstanding performance is a never-ending and complex process engaged in by researchers, engineers and practitioners. Computational assessment of organic corrosion inhibitors performance is a crucial step towards the design of new task-pecific materials. Herein, electronic features, adsorption characteristics and bonding mechanisms of two pyridine oximes, namely 2-pyridylaldoxime (2POH) and 3-pyridylaldoxime (3POH) with the iron surface were investigated using molecular dynamics (MD), and self-consistent-charge density-unctional tight-binding (SCC-DFTB) simulations. SCC-DFTB simulations revealed that 3POH molecule can form covalent bonds with iron atoms in its neutral and protonated states, while 2POH molecule can only bond with iron through its protonated form, resulting in interaction energies of -2.534, -2.007, -1.897, and -0.007 eV for 3POH, 3POH+, 2POH+, and 2POH, respectively. Projected density of states (PDOSs) analysis of pyridines-Fe(110) interactions indicated that pyridine molecules chemically adsorbed on the iron surface.

• 만화애니메이션 연구
• /
• 통권22호
• /
• pp.81-97
• /
• 2011

가상현실(Virtual Reality) 기술은 우리 시대에 인간의 희로애락(喜怒哀樂)을 담아내는 진보적 수단으로 자리 잡고 있다. 최근에 인지심리학 분야에서 치료도구로서 사용하기 위한 다양한 시도들이 일어나고 있다. 오감을 통한 가상세계속의 실재감은 현실세계의 인지(Cognition) 의 의미를 재해석해야 할 만큼 우리에게 폭넓게 다가오고 있다. 이러한 패러다임의 변화를 바탕으로 가상현실 기술들을 활용한 새로운 치료방법들이 가능해지고 있는데 그 대표적인 경우가 공황장애를 극복하기위한 행동치료 분야라고 할 수 있다. 특히 가상공간 내에서의 유연한 상호작용(Interaction) 기술의 발전은 환자들이 접할 수 있는 물리적 체험환경을 심리체험의 장으로 유도해 낼 수 있다는 장점을 가지고 있다. 상호작용 기술은 사용자의 물리적 오감을 보다 적극적으로 자극할 수 있는 환경을 제공하며, 가상세계로 부터의 체험정보는 인간으로 하여금 잠재된 에너지들을 새롭게 환기(喚起) 시켜 현실적 경험들로 체득시키기에 매우 유용한 것이다. 가상현실치료의 장점은 장애 환자들의 증상에 따른 맞춤형 치료가 가능하고 치료단계별로 차별화시켜 적용할 수도 있다는 것이다. 각각의 증상과 단계별로 이루어지는 치료과정을 거치면서 환자들로 하여금 현실세계 환경과 상황에 점차 익숙해지게 하여 장애를 치료하는 것이다. 감성공학을 기반으로 한 몰입형 가상현실장비와 반작용 되먹임(force-relative feedback)기술과 입체음향, 그리고 후각을 자극하는 기술들은 인간의 오감을 자극하여 경험을 환기(喚起)시키는데 유용하다. 가상세계에 대한 몰입 감이 주는 장점으로는 도전, 상호작용, 사실성, 환상, 협동성과 같은 현상들이 확대 된다는 점일 것이다. 이러한 현실보강(augmented reality)기능을 확장시켜 치료분야에 적용하고 있는 것으로 최근에는 인터넷을 통한 가상공간과 데이터의 공유기술, 그리고 저렴한 가용성이 그 저변을 확대시키고 있다. 인지적 경험을 위한 능동적인 상호작용 환경을 제공하는 가상현실 치료기술은 두려움 때문에 실제 상황에 직면할 수 없는 환자들에게 적절하게 조절된 환경을 제시해 줄 수 있으며, 비밀이 보장되고, 안전하며, 경제적이라는 이점이 있다. 또한, 실시간(Realtime) 내비게이션을 하는 것을 원칙으로 하기 때문에 빠른 수정보완이 가능하며 안경 없이 입체영상을 볼 수 있는 렌티큘라(lenticular)기술의 보급으로 보다 사실적인 실재감(Presence) 구현이 가능해져서 사이버 멀미현상을 줄일 수 있게 되었다. 그리고 대화식 기술의 발전으로 가상공간 속에서 직접 자신의 손을 이용해서 내비게이션을 하거나 물체를 조종함으로서 실세계와 유사한 실재감에 근접해 가고 있다. 본 논문은 제한적이기는 하지만 장애치료에 활용하고 있는 감성공학기반 가상현실 기술의 특성과 적용범위와 문제점들을 살펴보고 미래의 가능성을 조망해 보고자 한다.

• 대한화학회지
• /
• 제39권1호
• /
• pp.66-70
• /
• 1995

토양에서 얻어진 흄산(HA)을 한외 여과법을 이용 분자량에 따라 4개의 소부분(F1 : 100,000 dalton 이상; F2 : 100,000 dalton 이하;10,000 dalton 이하; F4 : 2,000 dalton 이하)으로 분리한 뒤 적외선 분광법과 핵자기 공명 분광법을 통하여 각 소부분들의 분광학적 특성을 규명하고 상호간에 비교 분석하였다. 4개 소부분들의 $1^H$과 $13^C$ NMR 스펙트럼은 전체적인 특성에서 모두 흄산 모액 스펙트럼과 유사하게 나타났다. 이 결과는 분자량이 변하더라도 흄산의 전체적 특성이 그대로 유지됨을 제시한다. 차이점으로는 IR 스펙트럼 결과 분자량이 적어지면서 다당류 성분 함량이 다소 감소된 반면 카르복실기 성분 함량은 조금 증가된 것으로 나타났다.