• 제목/요약/키워드: motion of molecules

검색결과 86건 처리시간 0.026초

Effect of Temperature on Photoinduced Reorientation of Azobenzee Chromophore in the Side Chain Copolymers

  • 최동훈
    • Bulletin of the Korean Chemical Society
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    • 제20권9호
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    • pp.1010-1016
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    • 1999
  • We synthesized the photoresponsive side chain polymers containing aminonitro azobenzene for studying the effect of temperature on photoinduced birefringence. Four different copolymers were prepared using methacrylate, α-methylstyrene, and itaconate monomer. Photoisomerization was observed under the exposure of UV light using UV-VIS absorption spectroscopy. Reorientation of polar azobenzene molecules induced optical anisotropy under a linearly polarized light at 532 nm. The change of the birefringence was observed with increasing the sample temperature under a continuous irradiation of excitation light. We could estimate the activation energy of molecular motion in thermal and photochemical mode. Besides the effect of glass transition temperature on the activation energy, we focused our interests on the effect of geometrical hindrance of polar azobenzene molecules and cooperative motion of environmental mesogenic molecules in the vicinity of polar azobenzene molecules.

Two-dimensional Surface Structures of Arenthiols Studied by STM

  • 권기영
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2012년도 제42회 동계 정기 학술대회 초록집
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    • pp.89-89
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    • 2012
  • Arrangement of individual atoms and molecules with atomic precision and understanding the resulting properties at the molecular level are ultimate goals of chemistry, biology, and materials science. For the past three decades, scanning probe microscopy has made strides towards these goals through the direct observation of individual atoms and molecules, enabling the discovery of new and unexpected phenomena. This talk will discuss the origin of forces governing motion of small organic molecules and their extended self-assembly into two-dimensional surface structures by direct observation of individual molecules using scanning tunneling microscopy (STM).

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Randomwalk 이론을 이용한 Web 기반 동영상 프로그램의 개발 (Development of Web-Based Simulation Program Using the Randomwalk Theory)

  • 김성근;김주래;우규환
    • 대한화학회지
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    • 제43권4호
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    • pp.469-474
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    • 1999
  • 본 연구에서는 Randomwalk 이론을 이용하여 동영상 프로그램을 개발하였다. 보통 화학 교과는 원자, 분자와 같은 입자의 행동을 이해하는데 어려움이 많아 이에 관한 학생들의 오개념이 많이 나타나고 있다. Randomwalk 이론을 도입한 동영상으로 분자 운동을 표현한 본 프로그램은 실제 분자 운동의 과정을 제대로 이해하는데 도움을 줄 것이다. 본 연구에서는 특히 JAVA 언어를 사용하여 Web 상에 프로그램을 구현함으로써 누구나 쉽게 이용할 수 있게 하였다. 이들 프로그램은 두가지의 프로그램으로 짜여져 있다. 하나는'Diffusion' 프로그램이며, 입자의 확산 과정을 실제와 같이 동영상으로 구현되도록 하였다. 또 다른 하나는 'Randomwalk' 프로그램으로 입자의 운동 과정에 대한 궤적을 표현함으로써 분자 운동에 대한 분명한 이해를 가능하게 하였다.

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Kuhn형 LB막 누적장치에서의 변위전류 측정 (Measurement of the displacement current using Kuhn-type LB film apparatus)

  • 송경호;박태곤;박근호;권영수;강도열
    • 대한전기학회:학술대회논문집
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    • 대한전기학회 1993년도 하계학술대회 논문집 B
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    • pp.1200-1202
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    • 1993
  • There are many methods to investigate the physical properties of monolayers formed at the air-water interface. Among them, the displacement current method is appropriate for the investigation of the dynamic behavior of monolayers. The measuring system of displacement current method was constructed at home-made Kuhn type LB deposition apparatus using aluminium plate electrode. The currents induced by the dynamic motion of molecules were measured when the molecules were pressed by barrier. To verify the measuring system, we used 4-octyl -4'-(5-carboxy-pentamethyleneoxy)-azobenzene molecules which has two remarkable variations of surface pressure of monolayer at the air-water interface. We can detect the two peaks of displacement currents which shows that the orientations of molecules are changed greatly at the state of these two remarkable changes of surface pressure.

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Microscopic Surface Dynamics Studied by Scanning Probe Microscopy

  • 권기영
    • 한국진공학회:학술대회논문집
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    • 한국진공학회 2011년도 제41회 하계 정기 학술대회 초록집
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    • pp.111-111
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    • 2011
  • Arrangement of individual atoms and molecules with atomic precision and understanding the resulting properties at the molecular level are ultimate goals of chemistry, biology, and materials science. For the past three decades, scanning probe microscopy has made strides towards these goals through the direct observation of individual atoms and molecules, enabling the discovery of new and unexpected phenomena. This talk will discuss the origin of forces governing motion of small organic molecules and their extended self-assembly into two-dimensional surface structures by direct observation of individual molecules using scanning tunneling microscopy (STM). In addition, atomic force microscopy (AFM) is utilized for the investigation of fundamental mechanisms of bone mineral dissolution by examining atomically well characterized simulated bone minerals under aqueous solution environments.

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Coherent director rotation and memory effects, and their dependence on the morphology of the constituent molecules in thiol-ene polymer stabilized ferroelectric liquid crystal system

  • Lim, Tong-Kun;Lee, Ji-Hoon
    • 한국정보디스플레이학회:학술대회논문집
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    • 한국정보디스플레이학회 2005년도 International Meeting on Information Displayvol.I
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    • pp.199-202
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    • 2005
  • We have studied the origin of coherent director rotation [CDR] as well as memory behavior in thiol-ene polymer stabilized ferroelectric liquid crystal [FLC]. The ene constituents are found to be always located at the inter-layer space and induce the coherent director rotation motion of liquid crystal molecule. On the other hand, the thiols are more intersticed between ferroelectric liquid crystal molecules at intra-layer as the thiol gets longer, and these intersticed thiols enhance the multistability and the resolution of memory state of FLCs.

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집광된 비공명레이저펄스의 쌍극자힘에 의한 중성 분자들의 분리 (Separation of Neutral Molecules by the Dipole Force of a Focused Nonresonant Laser Pulse)

  • Zhao, Bum-Suk;Lee, Sung-Hyup. Chung, Hoi-Sung;Hwang, Sun-Gu;Kang, Wee-Kyung;Chung, Doo-Soo
    • 한국광학회:학술대회논문집
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    • 한국광학회 2001년도 제12회 정기총회 및 01년도 동계학술발표회
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    • pp.272-273
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    • 2001
  • We demonstrate the first separation of neutral molecules using optical forces. Unlike laser atomic cooling or optical tweezers, optical separation technique requires the manipulation of only one component of the molecular motion. Thus the mixtures can be separated, in principle, with less complex schemes. When an Intense nonresonant laser beam is focused onto a beam of molecules, the interaction between the laser electric field and the induced dipole moment of a molecule invokes a mechanical force on the molecule proportional to the field gradient and the molecular polarizability ($\alpha$) to mass (m) ratio $\alpha$/m. (omitted)

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Dynamic Behavior of Photoinduced Birefringence of Copolymers Containing Aminonitro Azobenzene Chromophore in the Side Chain

  • 최동훈;강석훈
    • Bulletin of the Korean Chemical Society
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    • 제20권10호
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    • pp.1186-1194
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    • 1999
  • Photoresponsive side chain polymers containing aminonitro azobenzene were synthesized for studying optically induced birefringence. Four different copolymers were prepared using methacrylate, a-methylstyrene, and itaconate monomer. Two copolymers are totally amorphous and the other two are liquid crystalline in nature. Trans-to-cis photoisomerization was observed under the exposure of UV light with UV-VIS absorption spectroscopy. Reorientation of polar azobenzene molecules induced optical anisotropy under a linearly polarized light at 532 nm. The dynamic parameters of optically induced birefringence let us compare the effect of polymeric structure on the rate of growth and decay of the birefringence. Besides the effect of glass transition temperature on the dynamics of photoinduced birefringence, we focused our interests on the geometrical hindrance of polar azobenzene molecules and cooperative motion of environmental mesogenic molecules in the vicinity of polar azobenzene moiety.

Molecular Dynamics Simulation Study of Density Effects on Vibrational Dephasing in Diatomic Molecular Liquid $N_2$

  • Kwang-Jin Oh;Seung-Joon Jeon;Eok Kyun Lee;Tae Jun Park
    • Bulletin of the Korean Chemical Society
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    • 제15권2호
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    • pp.118-122
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    • 1994
  • Molecular dynamics simulation was carried out to study density effects on vibrational dephasing. Because of difficulty due to large time scale difference between vibrational motion and vibrational relaxation, we adopt adiabatic approximation in which the vibrational motion is assumed to be much faster than translational and rotational motion. As a result, we are able to study vibrational dephasing by simulating motion of rigid molecules. It is shown that the dephasing time is decreased as density increases and the contribution to this result is mainly due to the mean-squared frequency fluctuation.

노즐과 터빈에 대한 분자동력학 시뮬레이션 설계 및 구현 (Molecular Dynamics Simulation Design and Implementation for Nozzles and Turbines)

  • 김수희
    • 한국전자통신학회논문지
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    • 제14권1호
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    • pp.147-154
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    • 2019
  • 이 연구에서는 분자들이 노즐과 터빈내부에서 운동하는 거동을 모사하기 위해 분자동력학 시뮬레이션 시스템의 모델을 설계하고 개발하였다. Lennard-Jones Potential 모델을 이용하여 분자들간에 상호 작용을 계산하고, Verlet 알고리듬을 뉴턴의 운동 방정식을 적산하기 위한 수치해석 방법으로 사용하였다. Lennard-Jones Potential 함수를 계산하기 위해, 분자 개수 N에 대해 $O(N^2)$ 계산량을 cutoff $r_c$를 이용하여 O(N)으로 줄여서 계산하여 CPU 시간을 절약할 수 있도록 구현하였다.