• Title/Summary/Keyword: force-field calculations

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Calculations of the Trapping Force of Optical Tweezers using FDTD Method (FDTD 방법을 이용한 광집게의 포획 힘 계산)

  • Sung, Seung-Yong;Lee, Yong-Gu
    • Korean Journal of Optics and Photonics
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    • v.19 no.1
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    • pp.80-83
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    • 2008
  • Optical tweezers are a tool that can use a tightly focused laser beam to trap and manipulate micron-sized dielectric particles that are immersed in a medium with lower refractive index. In this paper, the calculation of the trapping force of optical tweezers is presented. A nonparaxial Gaussian beam is used to represent a tightly focused Gaussian beam, and the FDTD (Finite-Difference Time-Domain) method is used for computing the electromagnetic field distributions in the dielectric medium. Scattered-field formulation is used for analytical expression of the incident fields. Using the electromagnetic field distribution from FDTD simulation, the trapping force is calculated based on Maxwell's stress tensor.

Application of Molecular Mechanics to the Structure of 1,6-Anhydropyranoses (1,6-Anhydropyranose의 분자구조의 역학적응용)

  • George A. Jeffrey;Young Ja Park
    • Journal of the Korean Chemical Society
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    • v.23 no.4
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    • pp.206-209
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    • 1979
  • Empirical force-field calculations have been applied to eight 1,6-anhydropyra-noses, the crystal structures$^{13{\sim}21}$ of which have been studied by single crystal X-ray or neutron diffraction analysis. The theoretical calculations reproduce closely the variations in conformation between $^1C_4$ and $E_0$, which are observed in the pyranose rings. The smaller conformational differences in the five-membered anhydro ring are not so well predicted. The calculated C-C bond lengths agree with those observed within 0.012${\AA}$ with one exception. The C-O bond lengths show a larger deviation, 0.027${\AA}$. The non-hydrogen atom valence angles agree within 1.9$^{\circ}$.

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The Structure and Energy of D-Sorbitol from an Empirical force-Field (Empirical Force-Field 방법에 의한 D-Sorbitol 의 구조와 에너지에 관한 연구)

  • Park Young Ja
    • Journal of the Korean Chemical Society
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    • v.29 no.2
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    • pp.104-110
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    • 1985
  • Empirical force-field method has been applied to D-sorbitol, the crystal structure of which has been studied by the single crystal X-ray and neutron diffraction analyses. The calculated C-C bond lengths agree with those observed within 0.009${\AA}$. The C-O bond lengths show a larger deviation of 0. 023${\AA}$. The calculated C-C-C and C-C-O valence angles agree with those observed within $2.3^{\circ}$ and $1.9^{\circ}$respectively. Because torsion angles are influenced by packing forces, they show considerably flarger r. m. s. deviations. Calculations of the conformational energies of the model compound at selected C(1)-C(2)-C(3)-C(4) torsion angles made with the program MMI, produced result that the prediction of the observed preferred conformation of the carbon chain appeares to be less satisfactory.

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A Study about aerodynamic characteristics of High speed train by fore-body shape design (고속전철의 형상에 따른 공력특성 연구)

  • 진원재;이봉래
    • Proceedings of the Korean Society of Precision Engineering Conference
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    • 1997.10a
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    • pp.735-738
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    • 1997
  • The aerodynamic charateristics of high speed train can be improved by fore-body design. In this paper, the design a fore-body shape which has optimal aerodynamic charateristics, 6 models of fore-body shape are proposed and the change of aerodynamic characteristics is studied through calculations of flow field around high speed train fro each fore-body shape. The flow field around high speed trains are calculated using Navier-Stokes equation. The variational trends of aerodynamic characteristics are studied from the result of flow calculation around high speed trains for 6 fore-body shapes.

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A Study on the Design and Analysis of a Voice Coil Linear Force Motor for Hydraulic Valve (밸브구동용 보이스 코일 선형 포스모터 설계와 해석 연구)

  • Park, C.S.;Huh, J.Y.
    • Journal of Drive and Control
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    • v.9 no.4
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    • pp.1-7
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    • 2012
  • The voice coil linear force motor is a kind of a direct drive motion device that uses a permanent magnetic field and coil winding to produce force. In order to design a voice coil linear force motor, an exact calculations of the required force, the flux density in air gap and the flux pathway are needed. A conventional method can be used usually to calculate the flux density in air gap, but with this method it is needed to find a magnetic circuit revision constant. In this paper a voice coil linear force motor is designed by conventional design method and analyzed by 3D simulation program "Flux". For the prototype linear force motor, the results of the calculated by conventional design method and the analyzed by 3D simulation program are compared with the test result. Finally it is showed that the magnetic circuit revision constant which is found by comparing of the analyzed and the measured data can be used for the design of the voice coil type linear force motor to minimize the trial and error.

Normal Mode Studies for Solids HF, HCl and Polyethylene According to the Pseudolattice Method

  • Chang, Man-Chai;John, Mu-Shik
    • Bulletin of the Korean Chemical Society
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    • v.6 no.2
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    • pp.68-73
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    • 1985
  • Normal modes of solids HF, HCl and polyethylene having the exciting spectrometric phenomena have been evaluated by taking the lowest temperature phase of these species in the solid. The solids HF and HCl have the same space group as C$_{2}{\nu}$, and polyethylene has a space group with D$_{2h}$. The normal modes were obtained by the valence force field with modified force constants and a quantitative description of the normal mode is adjusted by the potential energy distribution (PED). From the PED, the most fittable force constants are also obtained. We have intended to calculate the normal modes by using the smallest size of the model and the simple computational process. To remove the edge effects being occurred in constructing the single cluster model, different from the boundary condition being generally used up to now, the idea of pseudolattice method being successfully applied to MO calculations of solid was extended to normal mode analysis in order to give the same environment for all moecules in a chosen cluster. By using the above valence force field and boundary condition, we obtain the assigned frequencies and compare those results with the results obtained by others.

A Numerical Study on the Toxic Gaseous and Solid Pollutant Dispersion in an Open Atmosphere (고-기상 유해물질 대기확산에 관한 수치해석)

  • 이선경;송은영;장동순
    • Journal of the Korean Society of Safety
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    • v.9 no.1
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    • pp.146-154
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    • 1994
  • A series of numerical calculations are performed in order to investigate the dispersion mechanism of toxic gaseous and solid pollutants in extremely short-term and short range. The calculations are carried out in an open space characterized by turbulent boundary layer. The simulation is made by the use of numerical model, in which a control-volume based finite difference method is used together with the SIMPLEC algorithm for the resolution of the pressure-velocity coupling problem. The Reynolds stresses are solved by two-equation, k-$\varepsilon$ model modified for buoyancy. The major parameters consider-ed in this study are temperature, velocity and Injection height of toxic gases, environmental conditions such as temperature and velocity of free stream air, and topographic factor. The results are presented and discussed in detail. The flow field is commonly characterized by the formation of a strong recirculation zone due to the upward motion of the hot toxic gas and ground shear stress. The driving force of the upward motion is explained by the effect of thermal buoyancy of hot gas and the difference of inlet velocity between toxic gas and free stream.

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Conformational Study of Benzene-Fused Ring Compound 1,2,3,4-Tetrahydronaphthalene Using Vibrational

  • Choo, Jae-Bum
    • Bulletin of the Korean Chemical Society
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    • v.18 no.10
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    • pp.1076-1082
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    • 1997
  • The infrared, Raman, and jet-cooled laser-induced fluorescence excitation spectra of 1,2,3,4-tetrahydronaphthalene have been recorded and analyzed. The observed vibrations have been assigned to understand the conformational behaviors in its electronic ground (S0) and excited (S1) states. Ab initio at the HF/6-31G** level and molecular mechanics (MM3) force field calculations have been carried out to generate the complete normal mode frequencies of the molecule in its S0 state. The vibrational frequencies calculated from the ab initio method show a better agreement with the observed infrared and Raman frequencies than those calculated from the MM3 method. In several cases, the normal mode calculations were very helpful to clarify some ambiguities of previous assignments. In addition, the ring inversion process between two twisted conformers of 1,2,3,4-tetrahydronaphthalene has been reexamined utilizing ab initio calculation. The results show that the ring inversion energy is in the range of 3.7-4.3 kcal/mol which is higher than the previously reported AM1 value of 2.1 kcal/mol.

Levitation characteristics of HTS tape stacks

  • Pokrovskiy, S.V.;Ermolaev, Y.S.;Rudnev, I.A.
    • Progress in Superconductivity and Cryogenics
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    • v.17 no.1
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    • pp.14-16
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    • 2015
  • Due to the considerable development of the technology of second generation high-temperature superconductors and a significant improvement in their mechanical and transport properties in the last few years it is possible to use HTS tapes in the magnetic levitation systems. The advantages of tapes on a metal substrate as compared with bulk YBCO material primarily in the strength, and the possibility of optimizing the convenience of manufacturing elements of levitation systems. In the present report presents the results of the magnetic levitation force measurements between the stack of HTS tapes containing $n=2{\div}200$ of tapes $12mm{\times}12mm$ and NdFeB permanent magnet in the FC and ZFC regimes. It was found a non- linear dependence of the levitation force from the height of the array of stack in both modes: linear growth at small thickness gives way to flattening and constant at large number of tapes in the stack. Established that the levitation force of stacks comparable to that of bulk samples. The numerical calculations using finite element method showed that without the screening of the applied field the levitation force of the bulk superconductor and the layered superconductor stack with a critical current of tapes increased by the filling factor is exactly the same, and taking into account the screening force slightly different.

Study of Lawson Formula at near- and far-field (근거리 및 원거리에서의 Lowson Formula에 대한 연구)

  • Wonju Jeon;Lee, Duck-Joo
    • Proceedings of the Korean Society for Noise and Vibration Engineering Conference
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    • 2001.11b
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    • pp.1393-1393
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    • 2001
  • This paper reviews the Lawson formula which predicts the sound field of a point force in arbitrary motion. The acoustic density was represented by an integral of integrand including the generalized function and its partial derivative at retarded time. After skillful integration, a mathematically exact formula was yielded with some terms which were still remained in need of numerical calculations. The significance of further mathematical progress is discussed in this paper. And also, the adequacy of procedures deriving the far- and near-field terms is investigated from the viewpoint of radiation.

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