• Title/Summary/Keyword: derivative-free method

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New Calibration Methods for improving the Accuracy of AFM (원자간력 현미경의 자율교정법)

  • Kweon, Hyun-Kyu;Go, Young-Chae
    • Proceedings of the KSME Conference
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    • 2001.06b
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    • pp.48-52
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    • 2001
  • In this paper presents an accurate AFM used that is free from the Z-directional distortion of a servo actuator is described. Two mathematical correction methods by the in-situ self-calibrationare employed in this AFM. One is the method by the integration, and the other is the method by inverse function of the calibration curve. The in situ self-calibration method by the integration, the derivative of the calibration curve function of the PZT actuator is calculated from the profile measurement data sets which are obtained by repeating measurements after a small Z-directional shift. Input displacement at each sampling point is approximately estimated first by using a straight calibration line. The derivative is integrated with reference to the approximate input to obtain the approximate calibration curve. Then the approximation of the input value of each sampling point is improved using the obtained calibration curve. Next the integral of the derivative is improved using the newly estimated input values. As a result of repeating these improving process, the calibration curve converges to the correct one, and the distortion of the AFM image can be corrected. In the in situ self-calibration through evaluating the inverse function of the calibration curve, the profile measurement data sets were used during the data processing technique. Principles and experimental results of the two methods are presented.

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ON THE CONVERGENCE OF THE UOBYQA METHOD

  • Han, Lixing;Liu, Guanghui
    • Journal of applied mathematics & informatics
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    • v.16 no.1_2
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    • pp.125-142
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    • 2004
  • We analyze the convergence properties of Powell's UOBYQA method. A distinguished feature of the method is its use of two trust region radii. We first study the convergence of the method when the objective function is quadratic. We then prove that it is globally convergent for general objective functions when the second trust region radius p converges to zero. This gives a justification for the use of p as a stopping criterion. Finally, we show that a variant of this method is superlinearly convergent when the objective function is strictly convex at the solution.

Wave Generation with a Hydrofoil by More Efficient Free-Surface Boundary Condition (고효율 자유표면 경계조건에 의한 수중익 주위의 파도생성)

  • Kwag, S.H.
    • Journal of Korean Port Research
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    • v.12 no.1
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    • pp.87-93
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    • 1998
  • For the calculation of the free-surface elevation, a new finite difference scheme is studied where the third derivative term for the wave elevation is artificially added in the Eulerian expression of the free-surface boundary condition. The paper presents a comparative analysis with simulations performed by the classical MAC method. More schematic computations are carried out by changing the submergence-depth and angle-of-attack. The present study shows that this new method is very efficient for the simulation of free-surface elevation around the trailing edge.

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A Study on the Acceleration and Deceleration Control of Free-Form Surfaces (자유곡면의 가감속 제어에 관한 연구)

  • Baek, Dae Kyun;Yang, Seung-Han
    • Journal of the Korean Society for Precision Engineering
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    • v.33 no.9
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    • pp.745-751
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    • 2016
  • This paper presents the acceleration and deceleration control of free-form surfaces. A rapid variation of acceleration (or Deceleration) drives the system into a machine shock, resulting in the inaccuracy of the path control of the NURBS curve. The pattern of acceleration control can be established using the curvature of the NURBS curve. The curvature can be easily calculated from the first and second derivative of the NURBS curve used in Taylor's expansion for NURBS interpolation. However, the derivatives are not used in the recursive method for NURBS interpolation. Hence, we attempted the difference-derivatives for calculating the NURBS curvature. Both, Taylor's expansion and the recursive method, are used jointly for controlling the acceleration in the same interpolation algorithm.

Molecular Modeling of Complexation Behavior of p-tert-Butylcalix[5]arene Derivative toward Butylammonium Ions

  • Choe, Jong-In;Chang, Suk-Kyu
    • Bulletin of the Korean Chemical Society
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    • v.23 no.1
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    • pp.48-52
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    • 2002
  • Using several molecular modeling programs we have performed computer simulations to investigate the complexation behaviors of an ester derivative of p-tert-butylcalix[5]arene (1e) toward a variety of butylammonium ions. Semi-empirical AM1 method was used for calculating the binding energies and the formation enthalpies. MM and CVFF forcefields for molecular mechanics calculations were adapted to express the complexation energies of the host. Molecular dynamics were performed to the calculated complex systems to simulate the ionophoric behavior of the host-guest complexes. The absolute Gibbs free energies of the host (1e) complexed with four kinds of butylammonium ions have been calculated using the Finite Difference Thermodynamic Integration (FDTI) method in Discover. Calculation results show that the trend in complex formation is n-$BuNH_3^+$ > iso-$BuNH_3^+$ >> sec-$BuNH_3^+$ > tert-$BuNH_3^+$, which is in good agreement with the experimental results.

Conformable solution of fractional vibration problem of plate subjected to in-plane loads

  • Fadodun, Odunayo O.;Malomo, Babafemi O.;Layeni, Olawanle P.;Akinola, Adegbola P.
    • Wind and Structures
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    • v.28 no.6
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    • pp.347-354
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    • 2019
  • This study provides an approximate analytical solution to the fractional vibration problem of thin plate governing anomalous motion of plate subjected to in-plane loads. The method of variable separable is employed to transform the fractional partial differential equations under consideration into a fractional ordinary differential equation in temporal variable and a bi-harmonic plate equation in spatial variable. The technique of conformable fractional derivative is utilized to solve the resulting fractional differential equation and the approach of finite sine integral transform method is used to solve the accompanying bi-harmonic plate equation. The deflection field which measures the transverse displacement of the plate is expressed in terms of product of Bessel and trigonometric functions via the temporal and spatial variables respectively. The obtained solution reduces to the solution of the free vibration problem of thin plate in literature. This work shows that conformable fractional derivative is an efficient mathematical tool for tracking analytical solution of fractional partial differential equation governing anomalous vibration of thin plates.

A Numerical Study on 2-Dimensuional Tank with Shallow Draft (천수에서 2차원 수치파 수조에 대한 계산)

  • 임춘규
    • Journal of Ocean Engineering and Technology
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    • v.14 no.1
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    • pp.1-5
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    • 2000
  • A numerical analysis for wave motion in the shallow water is presented. The method is based on potential theory. The fully nonlinear free surface boundary condition is assumed in an inner domain and this solution is matched along an assumed common boundary to a linear solution in outer domain. In two-dimensional problem Cauchy's integral theorem is applied to calculate the complex potential and its time derivative along boundary.

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HERMITE BICUBIC STREAM FUNCTION METHOD FOR INCOMPRESSIBLE FLOW COMPUTATIONS IN TWO DIMENSIONS (이차원 비압축성 유동 계산을 위한 Hermite 겹 3차 유동 함수법)

  • Kim, J.W.
    • Journal of computational fluids engineering
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    • v.13 no.4
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    • pp.13-23
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    • 2008
  • This paper is an extension of previous study[1] on a development of a divergence-free element method using a hermite interpolated stream function. Divergence-free velocity bases defined on rectangles derived herein produce pointwise divergence-free flow fields. Hence the explicit imposition of continuity constraint is not necessary and the Galerkin finite element formulation for velocities does not involve the pressure. The divergence-free element of the previous study employed hermite (serendipity) cubic for interpolation of stream function, and it has been noted a possible discontinuity in variables along element interfaces. This deficiency can be removed by use of a hermite bicubic interpolated stream function, which requires four degrees-of-freedom at each element corners. Those degrees-of-freedom are the unknown variable, its x- and y-derivatives and its cross derivative. Detailed derivations are presented for both solenoidal and irrotational basis functions from the hermite bicubic interpolated stream function. Numerical tests are performed on the lid-driven cavity flow, and results are compared with those from hermite serendipity cubics and a stabilized finite element method by Illinca et al[2].

HERMITE BICUBIC STREAM FUNCTION METHOD FOR INCOMPRESSIBLE FLOW COMPUTATIONS IN TWO DIMENSIONS (이차원 비압축성 유동 계산을 위한 Hermite 쌍 3차 유동 함수법)

  • Kim, J.W.
    • 한국전산유체공학회:학술대회논문집
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    • 2008.03a
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    • pp.33-41
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    • 2008
  • This paper is an extension of previous study[9] on a development of a divergence-free element method using a hermite interpolated stream function. Divergence-free velocity bases defined on rectangles derived herein produce pointwise divergence-free flow fields. Hence the explicit imposition of continuity constraint is not necessary and the Galerkin finite element formulation for velocities does not involve the pressure. The divergence-free element of the previous study employed hermite serendipity cubic for interpolation of stream function, and it has been noted a possible discontinuity in variables along element interfaces. This deficiency can be removed by use of a hermite bicubic interpolated stream function, which requires at each element corners four degrees-of-freedom such as the unknown variable, its x- and y-derivatives and its cross derivative. Detailed derivations are presented for both solenoidal and irrotational bases from the hermite bicubic interpolated stream function. Numerical tests are performed on the lid-driven cavity flow, and results are compared with those from hermite serendipity cubics and a stabilized finite element method by Illinca et al[7].

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HERMITE BICUBIC STREAM FUNCTION METHOD FOR INCOMPRESSIBLE FLOW COMPUTATIONS IN TWO DIMENSIONS (이차원 비압축성 유동 계산을 위한 Hermite 쌍 3차 유동 함수법)

  • Kim, J.W.
    • 한국전산유체공학회:학술대회논문집
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    • 2008.10a
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    • pp.33-41
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    • 2008
  • This paper is an extension of previous study[9] on a development of a divergence-free element method using a hermite interpolated stream function. Divergence-free velocity bases defined on rectangles derived herein produce pointwise divergence-free flow fields. Hence the explicit imposition of continuity constraint is not necessary and the Galerkin finite element formulation for velocities does not involve the pressure. The divergence-free element of the previous study employed hermite serendipity cubic for interpolation of stream function, and it has been noted a possible discontinuity in variables along element interfaces. This deficiency can be removed by use of a hermite bicubic interpolated stream function, which requires at each element corners four degrees-of-freedom such as the unknown variable, its x- and y-derivatives and its cross derivative. Detailed derivations are presented for both solenoidal and irrotational bases from the hermite bicubic interpolated stream function. Numerical tests are performed on the lid-driven cavity flow, and results are compared with those from hermite serendipity cubics and a stabilized finite element method by Illinca et al[7].

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