• Title/Summary/Keyword: free energy

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Free Vibration Characteristics of a String with Time-Varying Length (길이가 변하는 현의 자유진동 특성)

  • 이승엽;박상규
    • Journal of KSNVE
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    • v.9 no.5
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    • pp.906-913
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    • 1999
  • Time-dependent period and energy of free vibration of a string, whose length varies with time at a constant rate, are investigated by a traveling wave method. When the string length is increased, the vibration period increase, but the free vibration energy decrease with time. However, when the string undergoes retraction, the vibration energy increases with time. String tension together with non-zero instantaneous velocity at the moving boundary results in energy variation. Analytical solutions by the traveling wave method are compared with previous results using the perturbation method and Kotera's approach.

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A NONLINEAR CONVEX SPLITTING FOURIER SPECTRAL SCHEME FOR THE CAHN-HILLIARD EQUATION WITH A LOGARITHMIC FREE ENERGY

  • Kim, Junseok;Lee, Hyun Geun
    • Bulletin of the Korean Mathematical Society
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    • v.56 no.1
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    • pp.265-276
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    • 2019
  • For a simple implementation, a linear convex splitting scheme was coupled with the Fourier spectral method for the Cahn-Hilliard equation with a logarithmic free energy. However, an inappropriate value of the splitting parameter of the linear scheme may lead to incorrect morphologies in the phase separation process. In order to overcome this problem, we present a nonlinear convex splitting Fourier spectral scheme for the Cahn-Hilliard equation with a logarithmic free energy, which is an appropriate extension of Eyre's idea of convex-concave decomposition of the energy functional. Using the nonlinear scheme, we derive a useful formula for the relation between the gradient energy coefficient and the thickness of the interfacial layer. And we present numerical simulations showing the different evolution of the solution using the linear and nonlinear schemes. The numerical results demonstrate that the nonlinear scheme is more accurate than the linear one.

Study of protein loop conformational changes by free energy estimation using colony energy

  • Kang, Beom Chang;Lee, Gyu Rie;Seok, Chaok
    • Proceeding of EDISON Challenge
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    • 2014.03a
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    • pp.63-74
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    • 2014
  • Predicting protein loop structures is an important modeling problem since protein loops are often involved in diverse biological functions by participating in enzyme active sites, ligand binding sites, etc. However, loop structure prediction is difficult even when structures of homologous proteins are known due to large sequence and structure variability among loops of homologous proteins. Therefore, an ab initio approach is necessary to solve loop modeling problems. One of the difficulties in the development of ab initio loop modeling method is to derive an accurate scoring function that closely approximates the true free energy function. In particular, entropy as well as energy contribution have to be considered adequately for loops because loops tend to be flexible compared to other parts of protein. In this study, the contribution of conformational entropy is considered in scoring loop conformations by employing "colony energy" which was previously proposed to estimate the free energy for an ensemble of conformations. Loop conformations were generated by using two EDISON_Chem programs GalaxyFill and GalaxySC, and colony energy was designed for this sampling by tuning relevant parameters. On a test set of 40 loops, the accuracy of predicted loop structure improved on average by scoring with the colony energy compared to scoring by energy alone. In addition, high correlation between colony energy and deviation from the native structure suggested that more extensive sampling can further improve the prediction accuracy. In another test on 6 ligand-binding loops that show conformational changes by ligand binding, both ligand-free and ligand-bound states could be identified by using colony energy when no information on the ligand-bound conformation is used.

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Study on the Melting Point of Ar by Molecular Dynamic Simulation (Ar의 녹는점에 관한 분자동역학적 고찰)

  • Chung, Jae-Dong
    • Korean Journal of Air-Conditioning and Refrigeration Engineering
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    • v.19 no.12
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    • pp.883-888
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    • 2007
  • As a starting point of investigating what molecular dynamic simulations can reveal about the nature of atomic level of heating and cooling process, argon described by the LJ potential is considered. Stepwise heating and cooling of constant rates are simulated in the NPT (constant number, pressure and temperature) ensemble. Hysteresis is found due to the superheating and supercooling. Drastic change of volume and energy is involved with phase change, but the melting point can not be obtained by simply observing the changes of these quantities. Since liquid and solid phases can co-exist at the same temperature, Gibbs free energy should be calculated to find the temperature where the Gibbs free energy of liquid is equal to that of the solid since the equilibrium state is the state of minimum Gibbs free energy. The obtained melting temperature, $T^*=0.685$, is close to that of the experiment with only 2% error.

미래형 대형풍력발전기 개발 추세 (Europe 지역의 Case Study)

  • 오철수
    • Proceedings of the Korea Society for Energy Engineering kosee Conference
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    • 1998.05a
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    • pp.271-277
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    • 1998
  • 1. Why Wind Power\ulcorner Advantages of Wind Energy : free cost, non-pollutant, free waste large unit is possible Disadvantages : intermittent of energy density limited sites Unit Capacity of various Power Plant Solar PP : 10 - 500㎾ Wind PP : 200 - 2000 ㎾ Nuclear PP 700 - 1000 MW Installation Cost of Power Plants Nuclear PP : $ 2,500/㎾ Solar PP : $ 6,000/㎾ Wind PP : $ 1.000 /kw.

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Research on basic mechanical properties and damage mechanism analysis of BFUFARC

  • Yu H. Yang;Sheng J. Jin;Chang C. Shi;Wen P. Ma;Jia K. Zhao
    • Advances in concrete construction
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    • v.16 no.6
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    • pp.277-290
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    • 2023
  • In order to study the mechanical properties of basalt fiber reinforced ultra-fine fly ash concrete (BFUFARC), the effects of ultra-fine fly ash (UFA) content, basalt fiber content, basalt fiber length and water reducing agent content on the compressive strength, splitting tensile strength and flexural strength of the composite material were studied through experimental and theoretical analysis. Also, a scanning electron microscope (SEM) was employed to analyze the mesoscopic structure in the fracture surface of composite material specimens at magnifications of 500 and 3500. Besides, the energy release rate (Gc) and surface free energy (γs) of crack tip cracking on BFUFARC in different basalt fiber content were studied from the perspective of fracture mechanics. Further, the cracking resistance, reinforcement, and toughening mechanisms of basalt fibers on concrete substrate were revealed by surface free energy of BFUFARC. The experimental results indicated that basalt fiber content is the main influence factor on the splitting tensile strength of BFUFARC. In case that fiber content increased from 0 to 0.3%, the concrete surface free energy at the tip of single-sided crack showed a trend of increased at first and then decreased. The surface free energy reached at maximum, about 3.59 × 10-5 MN/m. During the process of increasing fiber content from 0 to 0.1%, GC-2γS showed a gradually decreasing trend. As a result, an appropriate amount of basalt fiber can play a preventing cracking role by increasing the concrete surface free energy, further effectively improve the concrete splitting tensile performance.

The technological state of the art of wave energy converters

  • GURSEL, K. Turgut
    • Advances in Energy Research
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    • v.6 no.2
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    • pp.103-129
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    • 2019
  • While global demand for energy increases annually, at the same time the demand for carbon-free, sulphur-free and NOx-free energy sources grows considerably. This state poses a challenge in the research for newer sources like biomass and shale gas as well as renewable energy resources such as solar, wind, geothermal and hydraulic energy. Although wave energy also is a form of renewable energy it has not fully been exploited technically and economically so far. This study tries to explain those reasons in which it is beyond doubt that the demand for wave energy will soon increase as fossil energy resources are depleted and environmental concerns gain more importance. The electrical energy supplied to the grid shall be produced from wave energy whose conversion devices can basically work according to three different systems. i. Systems that exploit the motions or shape deformations of their mechanisms involved, being driven by the energy of passing waves. ii. Systems that exploit the weight of the seawater stored in a reservoir or the changes of water pressure by the oscillations of wave height, iii. Systems that convert the wave motions into air flow. One of the aims of this study is to present the classification deficits of the wave energy converters (WECs) of the "wave developers" prepared by the European Marine Energy Center, which were to be reclassified. Furthermore, a new classification of all WECs listed by the European Marine Energy Center was arranged independently. The other aim of the study is to assess the technological state of the art of these WECs designed and/or produced, to obtain an overview on them.

A Study on the Design of the Free-Piston Stirling Engine/Alternator (자유 피스톤 스털링엔진/발전기의 설계 인자 연구)

  • Park, Seongje;Hong, Yongju;Ko, Junseok;Kim, Hyobong;Yeom, Hankil;In, Sehwan;Kang, Insu;Lee, Cheongsu
    • Transactions of the Korean hydrogen and new energy society
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    • v.25 no.6
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    • pp.648-655
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    • 2014
  • This paper describes the continuing effort to develope a single acting free-piston Stirling engine/alternator combination for use of the household cogeneration. Free piston Stirling engines(FPSE) use variations of working gas pressure to drive mechanically unconstrained reciprocating elements. Stirling cycle free-piston engines are driven by the Stirling thermodynamic cycle which is characterized by an externally heated device containing working gas that is continuously re-used in a regenerative, reversible cycle. The ideal cycle is described by two isothermal process connected by two constant volume processes. Heat removed during the constant volume cooling process is internally transferred to the constant volume heating process by mutual use of a thermal storage medium called the regenerator. Since the ideal cycle is reversible, the ideal efficiency is that of Carnot. Free-piston Stirling engine is have no crank and rotating parts to generate lateral forces and require lubrication. The FPSE is typically comprised of two oscillating pistons contained in a common cylinder. The temperature difference across the displacer maintains the oscillations, and the FPSE operate at natural frequency of the mass-spring system. The power is generated from a linear alternator. The purpose of this paper is to describe the design process of the single acting free-piston Stirling engine/alternator. Electrical output of the single acting free-piston Stirling engine/alternator is about 0.95 kW.

Calculations of Free Energy Surfaces for Small Proteins and a Protein-RNA Complex Using a Lattice Model Approach

  • Lee, Eun-Sang;Jung, Youn-Joon
    • Bulletin of the Korean Chemical Society
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    • v.32 no.spc8
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    • pp.3051-3056
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    • 2011
  • We calculate the free energy surfaces for two small proteins and a protein-RNA complex system by using a lattice model approach. In particular, we employ the Munoz-Eaton model, which is a native-structure based statistical mechanical model for studying protein folding problem. The model can provide very useful insights into the folding mechanisms by allowing one to calculate the free energy surfaces efficiently. We first calculate the free energy surfaces of ubiquitin and BBL, using both approximate and recently developed exact solutions of the model. Ubiquitin exhibits a typical two-state folding behavior, while BBL downhill folding in our study. We then extend the method to study of a protein-RNA complex. In particular, we focus on PAZ-siRNA complex. In order to elucidate the interplay between folding and binding kinetics for this system we perform comparative studies of PAZ only, PAZ-siRNA complex and two mutated complexes. We find that folding and binding are strongly coupled with each other and the bound PAZ is more stable than the unbound PAZ. Our results also suggest that the binding sites of the siRNA may serve act as a nucleus in the folding process.

Microstructure of ZrC Coatings of TRISO Coated Particles by Codeposition of Free Carbon and Control of Stoichiometry (유리탄소의 동시증착에 의한 TRISO 피복입자의 ZrC 코팅층 미세구조와 화학양론비 제어)

  • Ko, Myung-Jin;Kim, Daejong;Park, Ji Yeon;Cho, Moon Sung;Kim, Weon-Ju
    • Journal of the Korean Ceramic Society
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    • v.50 no.6
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    • pp.446-450
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    • 2013
  • TRISO coated particles with a ZrC barrier layer were fabricated by a fluidized-bed chemical vapor deposition (FBCVD) method for a use in a very high temperature gas-cooled reactor (VHTR). The ZrC layer was deposited by the reaction between $ZrCl_4$ and $CH_4$ gases at $1500^{\circ}C$ in an $Ar+H_2$ mixture gas. The amount of free carbon codeposited with in ZrC was changed by controlling the dilution gas ratio. Near-stoichiometric ZrC phase was also deposited when an impeller was employed to a $ZrCl_4$ vaporizer which effectively inhibited the agglomeration of $ZrCl_4$ powders during the deposition process. A near-stoichiometric ZrC coating layer had smooth surface while ZrC containing the free carbon had rough surface with tumulose structure. Surface roughness of ZrC increased further as the amount of free carbon increased.