• Title/Summary/Keyword: Reaction Dynamics

Search Result 389, Processing Time 0.022 seconds

Oxidative N-Debenzylation of N-Benzyl-N-substituted Benzylamines Catalyzed by Cytochrome P450

  • Kim, Sung-Soo;Lin, Gang;Yang, Ji-Won
    • Bulletin of the Korean Chemical Society
    • /
    • v.25 no.2
    • /
    • pp.249-252
    • /
    • 2004
  • Cytochrome P450 (P450)/$O_2$/NADPH engender electron transfer reaction of N-benzyl-N-substituted benzylamines to yield corresponding radical cation 1 that is simultaneously converted into 2 and 3. Subsequently, expulsion of proton and hydroxylation yielding a-hydroxylamines are followed by formation of benzaldehydes and benzylamines.

Inertial Motion Sensing-Based Estimation of Ground Reaction Forces during Squat Motion (관성 모션 센싱을 이용한 스쿼트 동작에서의 지면 반력 추정)

  • Min, Seojung;Kim, Jung
    • Journal of the Korean Society for Precision Engineering
    • /
    • v.32 no.4
    • /
    • pp.377-386
    • /
    • 2015
  • Joint force/torque estimation by inverse dynamics is a traditional tool in biomechanical studies. Conventionally for this, kinematic data of human body is obtained by motion capture cameras, of which the bulkiness and occlusion problem make it hard to capture a broad range of movement. As an alternative, inertial motion sensing using cheap and small inertial sensors has been studied recently. In this research, the performance of inertial motion sensing especially to calculate inverse dynamics is studied. Kinematic data from inertial motion sensors is used to calculate ground reaction force (GRF), which is compared to the force plate readings (ground truth) and additionally to the estimation result from optical method. The GRF estimation result showed high correlation and low normalized RMSE(R=0.93, normalized RMSE<0.02 of body weight), which performed even better than conventional optical method. This result guarantees enough accuracy of inertial motion sensing to be used in inverse dynamics analysis.

Experimental Analysis on Influences of Kinesthetic and Visual Sensations in a Human-Machine Cooperative System Considering Machine Dynamics

  • Tomonori, Yamamoto;Yoshiki, Matsuo;Takeshi, Inaba
    • 제어로봇시스템학회:학술대회논문집
    • /
    • 2003.10a
    • /
    • pp.1553-1558
    • /
    • 2003
  • The authors investigate influences of manipulator dynamics on and roles of kinesthetic sensation and visual sensation in a Human-Machine Cooperative System (HMCS). At first, the general structure and essential transfer functions of HMCSs are described based on the previous work. Then, after showing theoretical treatment of manipulator dynamics, this paper analyzes the influences on HMCSs in two cases: one is the control design focusing on tool dynamics and reaction force transfer function, and the other is that specifies maneuver transfer function and transfer function for object dynamics variation. In addition to conventional experiments only employing kinesthetic sensation, other experiments with both kinesthetic and visual sensations are performed to examine difference in the roles of these sensations and the validity of the design without the visual sensation.

  • PDF

Theoretical Studies on Mechanism and Kinetics of the Hydrogen-Abstraction Reaction of CF3CH2CHO with OH Radicals

  • Ci, Cheng-Gang;Yu, Hong-Bo;Wan, Su-Qin;Liu, Jing-Yao;Sun, Chia-Chung
    • Bulletin of the Korean Chemical Society
    • /
    • v.32 no.4
    • /
    • pp.1187-1194
    • /
    • 2011
  • The hydrogen abstraction reaction of $CF_3CH_2CHO$ + OH has been studied theoretically by dual-level direct dynamics method. Two stable conformers, trans- and cis-$CF_3CH_2CHO$, have been located, and there are four distinct OH hydrogen-abstraction channels from t-$CF_3CH_2CHO$ and two channels from c-$CF_3CH_2CHO$. The required potential energy surface information for the kinetic calculation was obtained at the MCG3-MPWB//M06-2X/aug-cc-pVDZ level. The rate constants, which were calculated using improved canonical transitionstate theory with small-curvature tunneling correction (ICVT/SCT) were fitted by a four-parameter Arrhenius equation. It is shown that the reaction proceeds predominantly via the H-abstraction from the -CHO group over the temperature range 200-2000 K. The calculated rate constants were in good agreement with the experimental data between 263 and 358 K.

Influence of Coal Conversion Model and Turbulent Mixing Rate in Numerical Simulation of a Pulverized-coal-fired Boiler (미분탄 보일러 연소 해석에서 석탄 반응 모델 및 난류 혼합 속도의 영향 평가)

  • Yang, Joo-Hyang;Kim, Jung-Eun A.;Ryu, Changkook
    • Journal of the Korean Society of Combustion
    • /
    • v.20 no.3
    • /
    • pp.35-42
    • /
    • 2015
  • Investigating coal combustion in a large-scale boiler using computational fluid dynamics (CFD) requires a combination of flow and reaction models. These models include a number of rate constants which are often difficult to determine or validate for particular coals or furnaces. Nonetheless, CFD plays an important role in developing new combustion technologies and improving the operation. In this study, the model selection and rate constants for coal devolatilization, char conversion, and turbulent reaction were evaluated for a commercial wall-firing boiler. The influence of devolatilization and char reaction models was found not significant on the overall temperature distribution and heat transfer rate. However, the difference in the flame shapes near the burners were noticeable. Compared to the coal conversion models, the rate constant used for the eddy dissipation rate of gaseous reactions had a larger influence on the temperature and heat transfer rate. Based on the operation data, a value for the rate constant was recommended.

Influence of coal and air flow rate distribution on gasification characteristics in 200 t/d scale MHI coal gasifier (200 t/d급 MHI 석탄 가스화기의 석탄 및 공기 배분에 따른 가스화 특성 평가)

  • Doh, Yunyoung;Ye, Insoo;Kim, Bongkeun;Ryu, Changkook
    • 한국연소학회:학술대회논문집
    • /
    • 2015.12a
    • /
    • pp.93-96
    • /
    • 2015
  • Commercial coal gasifiers typically use entrained flow type reactors, but have unique features in terms of reactor shape, gasifying agent, coal feeding type, ash/slag discharge, and reaction stages. The MHI gasifier is characterized as air-blow dry-feed entrained reactor, which incorporates a short combustion stage at the bottom and a tall gasification stage above. This study investigates the flow and reaction characteristics inside a MHI gasifier by using computational fluid dynamics (CFD) in order to understand its design and operation features. For its pilot-scale system at 200 ton/day capacity, the distribution of coal and air supply between the two reaction stages was varied. It was found that the syngas composition and carbon conversion rate were not significantly influenced by the changes in the distribution of coal and air supply. However, the temperature, velocity and flow pattern changed sensitively to the changes in the distribution of coal and air supply. The results suggest that one key factor to determine the operational ranges of coal and air supply would be the temperature and flow pattern along the narrower wall between the two reaction stages.

  • PDF

CONVERGENCE PROPERTIES OF PREDATOR-PREY SYSTEMS WITH FUNCTIONAL RESPONSE

  • Shim, Seong-A
    • Honam Mathematical Journal
    • /
    • v.30 no.3
    • /
    • pp.411-423
    • /
    • 2008
  • In the field of population dynamics and chemical reaction the possibility or the existence of spatially and temporally nonhomogeneous solutions is a very important problem. For last 50 years or so there have been many results on the pattern formation of chemical reaction systems studying reaction systems with or without diffusions to explain instabilities and nonhomogeneous states arising in biological situations. In this paper we study time-dependent properties of a predator-prey system with functional response and give sufficient conditions that guarantee the existence of stable limit cycles.

EXISTENCE OF RANDOM ATTRACTORS FOR STOCHASTIC NON-AUTONOMOUS REACTION-DIFFUSION EQUATION WITH MULTIPLICATIVE NOISE ON ℝn

  • Mosa, Fadlallah Mustafa;Ma, Qiaozhen;Bakhet, Mohamed Y.A.
    • Korean Journal of Mathematics
    • /
    • v.26 no.4
    • /
    • pp.583-599
    • /
    • 2018
  • In this paper, we are concerned with the existence of random dynamics for stochastic non-autonomous reaction-diffusion equations driven by a Wiener-type multiplicative noise defined on the unbounded domains.

Modeling dynamic interactions between the support foot and the ground in bipedal walking

  • Jung, Moon-Ryul
    • Journal of the Korea Computer Graphics Society
    • /
    • v.1 no.2
    • /
    • pp.201-212
    • /
    • 1995
  • This paper presents a new method of dynamics-based synthesis of bipedal, especially human, walking. The motion of the body at a time point is determined by ground reaction force and torque under the support foot and joint torques of the body at that time point. Motion synthesis involves specifying conditions that constrain ground reaction force and torque, and joint torques so that a given desired motion may be achieved. There are conditions on a desired motion which end-users can think of easily, e.g. the goal position and orientation of the swing foot for a single step and the time period of a single step. In this paper, we specify constraints on the motion of the support foot, which end-users would find difficult to specify. They are constraints which enforce non-sliding, non-falling, and non-spinning the support foot. They are specified in terms of joint torques and ground reaction force and torque. To satisfy them, both joint torques and ground reaction force and torque should be determined appropriately. The constraints on the support foot themselves do not give any good clues as to how to determine ground reaction force and torque. For that purpose, we specify desired trajectories of the application point of vertical ground reaction force (ground pressure) and the application point of horizontal ground reaction (friction) force. The application points of vertical pressure and friction force are good control variables, because they are indicators to kinds of walking motions to synthesize. The synthesis of a bipedal walking motion, then, consists of finding a trajectory of joint torques to achieve a given desired motion, so that the constraints are satisfied under the condition of the prescribed center of pressure and center of friction. Our approach is distinguished from many other approaches, e.g. the inverted-pendulum approach, in that it captures and formulates dynamics of the support foot and reasonable constraints on it.

  • PDF