• Title/Summary/Keyword: free energy

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Atmospheric Pressure Plasma Research Activity in Korea

  • Uhm, Han S.
    • Journal of Surface Science and Engineering
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    • v.34 no.5
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    • pp.367-377
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    • 2001
  • Plasma is generated by electrical discharge. Most plasma generation has been carried out at low-pressure gas typically less than one millionth of atmospheric pressure. Plasmas are in general generated from impact ionization of neutral gas molecules by accelerated electrons. The energy gain of electrons accelerated in an electrical field is proportional to the mean free path. Electrons gain more energy at low-pressure gas and generate plasma easily by ionization of neutrals, because the mean free path is longer. For this reason conventional plasma generation is carried out at low pressures. However, many practical applications require plasmas at high-pressure. In order to avoid the requirement for vacuum pumps, researchers in Korea start to develop plasmas in high-pressure chambers where the pressure is 1 atmosphere or greater. Material processing, environmental protection/restoration and improved energy production efficiency using plasmas are only possible for inexpensive bulk plasmas. We thus generate plasmas by new methods and plan to set foundations for new plasma technologies for $21^{st}$ / century industries. This technological research will play a central role in material processing, environmental and energy production industries.

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A Minimalist Model of Single Molecule Spectroscopy in a Dynamic Environment Studied by Metadynamics

  • Oh, In-Rok;Lee, Eun-Sang;Jung, Youn-Joon
    • Bulletin of the Korean Chemical Society
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    • v.33 no.3
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    • pp.980-986
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    • 2012
  • In this paper we develop a minimalist model of single molecule spectroscopy in a dynamic environment. Our model is based upon a lattice system consisting of a probe molecule embedded in an Ising-model like environment. We assume that the probe molecule interacts with the Ising spins via a dipole-dipole potential, and calculate free energy curves and lineshapes of the system. To investigate fluctuation behavior of the system we exploit the metadynamics sampling method. In particular, using the method, we calculate the free energy curve of magnetization of the lattice and that of the transition energy of the probe molecule. Furthermore, we compare efficiencies of three different sampling methods used; unbiased, umbrella, and metadynamics sampling methods. Finally, we explore the lineshape behavior of the probe molecule as the system undergoes a phase transition from a sub-critical and to a super-critical temperature. We show that the transition energy of a probe molecule is broadly distributed due to the heterogeneous, local environments.

Molecular dynamics simulation of bulk silicon under strain

  • Zhao, H.;Aluru, N.R.
    • Interaction and multiscale mechanics
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    • v.1 no.2
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    • pp.303-315
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    • 2008
  • In this paper, thermodynamical properties of crystalline silicon under strain are calculated using classical molecular dynamics (MD) simulations based on the Tersoff interatomic potential. The Helmholtz free energy of the silicon crystal under strain is calculated by using the ensemble method developed by Frenkel and Ladd (1984). To account for quantum corrections under strain in the classical MD simulations, we propose an approach where the quantum corrections to the internal energy and the Helmholtz free energy are obtained by using the corresponding energy deviation between the classical and quantum harmonic oscillators. We calculate the variation of thermodynamic properties with temperature and strain and compare them with results obtained by using the quasi-harmonic model in the reciprocal space.

Second order VOF convection model in curvilinear coordinates

  • Kim, Seong-O.;Hwang, Young-dong;Kim, Young-In.;Chang, Moon-Hee
    • Proceedings of the Korean Nuclear Society Conference
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    • 1997.05a
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    • pp.392-399
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    • 1997
  • An approximation technique was developed for the simulation of free surface flows in non-orthogonal coordinates. The main idea of this approach is to approximate VOF by the second order linear equation in the transformed domain on the assumption that the continuity of free surface would be maintained. The method was justified through a set of numerical test to examine if its original shape could be maintained when the circles are convected in uniform velocity in horizontal direction in curvilinear coordinates. Finally a simple problem was solved by applying the method to CFX4.1 general purpose CFDS code.

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Thermodynamic Properties of Aliphatic and Aromatic Hydrocarbons in Liquid Water (물속에서의 지방족 및 방향족 탄화수소들의 열역학적 성질)

  • Sung Yong Kiel;Kim Un Shik;Jhon Mu Shik
    • Journal of the Korean Chemical Society
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    • v.16 no.5
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    • pp.265-270
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    • 1972
  • The aqueous solutions of aliphatic and aromatic hydrocarbons have been studied on the basis of the significant structure theory of liquid water proposed by Jhon, et al. The thermodynamic properties such as Helmholtz free energy, internal energy entropy, and heat capacity have been calculated. The results show good agreements with the experiments in the literature.

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Thermal dissociation of excitons bound to neutral acceptors in CdTe single crystal (CdTe 단결정에서 중성 받게에 구속된 엑시톤의 열 해리)

  • 박효열
    • Journal of the Korean Crystal Growth and Crystal Technology
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    • v.10 no.3
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    • pp.185-188
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    • 2000
  • The dissociation of excitons bounds to neutral accepter in CdTe single crystal was investigated by measurement of temperature dependence of the photoluminescence spectra. The binding energies of CdTe single crystal were determined by PL spectrum at 12K. The free exciton (X) binding energy, the exciton binding energy on neutral donor ($D^{\circ}$, X), and the exciton binding energy on neutral acceptor ($A^{\circ}$, X) were 10 meV, 3.49 meV, and 7.17 meV respectively. From the value of activation energy of ($A^{\circ}$, X), we could show that the dissociation of ($A^{\circ}$, X) is attributed to free exciton.

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Analysis of Performance of Building Integrated PV System into Cold Facade (건물일체형 Cold Facade PV 시스템의 성능 분석)

  • Kim, Hyun-Il;Kang, Gi-Hwan;Park, Kyung-Eun;Yu, Gwon-Jong;Suh, Seung-Jik
    • Proceedings of the KIEE Conference
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    • 2008.07a
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    • pp.1104-1105
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    • 2008
  • This paper presents the assesment of experimented data and estimated data for electrical and thermal performance evaluation of building integrated photovoltaic(BIPV) system of cold facade type. BIPV module is used to estimate the dependence of module temperature on irradiance, ambient temperature and indoor temperature. The module temperature of no free ventilated facade PV system is higher than cold facade PV system about 13.4$^{\circ}C$. By the results on simulation, the reduction of electrical power loss is 9.57% into cold facade according to free ventilation. The annual averaged PR of BIPV system into cold facade is about 73.1%.

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A study on modelling for ACL and PCL using various strain energy functions (다양한 변형률 에너지 함수를 사용한 전방 및 후방 십자 인대의 모델링에 관한 연구)

  • Lim, Jun-Taek;Choi, Deok-Kee;Kim, Young-En
    • Proceedings of the KSME Conference
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    • 2008.11a
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    • pp.658-663
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    • 2008
  • The mechanical study on the anterior and posterior cruciate ligament(ACL, PCL) is of importance because the recent increase of outdoor and indoor activities is directly related to causing sport injuries on the knee joints. Constitutive models for many biological tissues have been known as hyperelasticitic models. The elastic behavior of ACL and PCL may be described by the free energy function which accounts for the matrix and the collagen fibers. This paper addresses a comparison of different types of the free energy function to the existing results.

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Analysis on the Ventilation Rate of Express Bus according to the Geometry of Vent (고속버스의 환기구 형태에 따른 환기량 분석)

  • Shin, In-Hwaw;Yoo, Ho-Chun
    • 한국태양에너지학회:학술대회논문집
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    • 2011.04a
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    • pp.174-178
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    • 2011
  • This paper deals with the free cooling system of express bus using natural energy source in order to improve the room air quality and save cooling energy. In an express bus, there are may passengers in unit area, requiring the improvement of air quality and giving higher energy saving efficiency. Particularly, the express buses running fast make it easy to take in outdoor air at a flow rate controllable with a damper mechanism. This paper proposes the analysis on the air flow achieved by a damper controlled vertically and horizontally in order not to deteriorate the ride comfort of the passengers.

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Flip-Flop of Phospholipids in DMPC/POPC Mixed Vesicles

  • Kim, Min Ki;Kim, Chul
    • Journal of the Korean Chemical Society
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    • v.64 no.3
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    • pp.145-152
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    • 2020
  • Flip-flop rate constants were measured by dithionite assay of NBD-PE fluorescence in DMPC/POPC vesicles made of various DMPC/POPC ratios. The activation energy, enthalpy, entropy, and free energy were determined based on the transition state theory. We found that the activation energy, enthalpy, and entropy increased as the amount of POPC increased, but the activation free energy was almost constant. These experimental results and other similar studies allow us to propose that the POPC molecules included in DMPC vesicles affect the flip-flop motion of NBD-PE in DMPC/POPC vesicles via increasing the packing order of the ground state of the bilayer of the vesicles. The increase in the packing order in the ground state seems to be a result of the effect of the overall molecular shape of POPC with a monounsaturated tail group, rather than the effect of the longer tail group.