• Title/Summary/Keyword: Schrodinger equation

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A Study of the Characteristics and Mechanism of Giant wave Appearance (대양에서의 거대파랑 출현 특성과 기구에 관한 연구)

  • Shin Seung-Ho;Hong Keyyong
    • Proceedings of the Korean Institute of Navigation and Port Research Conference
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    • 2005.10a
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    • pp.147-152
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    • 2005
  • 선형파 이론에 의한 파랑스펙트럼 분포에 의해서는 30m 크기의 파랑은 현실적으로 거의 발생 불가능하다고 인식되어 왔다. 그러나 최근의 위성 영상을 이용한 조사에 의해 3주간의 기간 통안 25m 이상의 거대파가 10개 이상 관측됨에 따라 실해역에서 빈번히 마주칠 수 있는 현상임이 입증되었으며 이에 따라 지금까지 이유 불명으로 치부되어 왔던 많은 해양 재난이 거대파에 의해 발생했던 것으로 추정되고 있다. 거대파의 발생원인은 파군 형성과 관련한 파고분포 특성의 변화, 전파하는 파군의 비선형 공명간섭 통이 제기되고 있으나, 그 출현의 복잡성과 자료의 부족 등으로 아직 명확하게 해명되지 못하고 있다. 본 연구에서는 실해역에서 발생하는 거대파의 특성 및 선형 및 비선형이론에 근거한 거대파 발생 기구를 고찰하고 비선형 파랑전파를 모사할 수 있는 수치모형을 개발하였다.

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Analysis of Tunnelling Rate Effect on Single Electron Transistor

  • Sheela, L.;Balamurugan, N.B.;Sudha, S.;Jasmine, J.
    • Journal of Electrical Engineering and Technology
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    • v.9 no.5
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    • pp.1670-1676
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    • 2014
  • This paper presents the modeling of Single Electron Transistor (SET) based on Physical model of a device and its equivalent circuit. The physical model is derived from Schrodinger equation. The wave function of the electrode is calculated using Hartree-Fock method and the quantum dot calculation is obtained from WKB approximation. The resulting wave functions are used to compute tunneling rates. From the tunneling rate the current is calculated. The equivalent circuit model discuss about the effect of capacitance on tunneling probability and free energy change. The parameters of equivalent circuit are extracted and optimized using genetic algorithm. The effect of tunneling probability, temperature variation effect on tunneling rate, coulomb blockade effect and current voltage characteristics are discussed.

A split kinetic energy solution scheme applied to various delta potentials in quantum mechanical systems

  • Chen, Yu-Hsin;Chao, Sheng D.
    • Coupled systems mechanics
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    • v.6 no.1
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    • pp.17-28
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    • 2017
  • In this work, we extend the previously developed split kinetic energy (dubbed KEP) method by Mineo and Chao (2012) by modifying the mass parameter to include the negative mass. We first show how to separate the total system into the subsystems with 3 attractive delta potentials by using the KEP method. For repulsive delta potentials, we introduce "negative" mass terms. Two cases are demonstrated using the "negative" mass terms for repulsive delta potential problems in quantum mechanics. Our work shows that the KEP solution scheme can be used to obtain not only the exact energies but also the exact wavefunctions very precisely.

Theoretical Investigation of the Vibrational Relaxation of NO(${\upsilon}=1-7$) in Collisions with $O_{2}\;and\;N_{2}$

  • Jongbaik Ree
    • Bulletin of the Korean Chemical Society
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    • v.14 no.1
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    • pp.47-52
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    • 1993
  • The vibrational relaxation rate constants of NO(v = 1-7) by $O_2\;and\;N_2$ have been calculated in the temperature range of 300-1000 K using the solution of the time-dependent Schrodinger equation. The calculated relaxation rate constants by $O_2$ increase monotonically with the vibrational energy level v, which is compatible with the experimental data, while those by $N_2$ are nearly independent of v in the range of $3.40 {\pm}1.60{\times}10_{-16} cm^3$/molecule-sec at 300 K. Those for NO(v) + $N_2$ are about 2-3 orders of magnitude smaller than those for NO(v) + $O_2$, because the latter is an exothermic processes while the former an endothermic. Relaxation processes can be interpreted by single-quantum V-V transition. The contributions of V-T/R transition and double-quantum V-V transition to the relaxation are negligible over the entire temperature range.

Temperature Dependence of the Vibration-Vibration Energy Transfer in the Deexcitaion of NO(2) by NO(0)

  • Ree, Jong-Baik;Sohn, Chang-Kook;Lee, Chang-Soon;Kim, Yoo-Hang
    • Bulletin of the Korean Chemical Society
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    • v.8 no.6
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    • pp.449-453
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    • 1987
  • The temperature dependence of the vibrational relaxation of NO(= 2) by NO(v = 0) has been investigated over the temperature range 100-3000 K. We have assumed that the deexcitation of NO(2) by NO(0) undergoes vibration-to-vibration (VV) energy exchange with the transfer of the energy mismatch ${\Delta}$E through rotation (R) and translation(T). The relaxation rate constants are calculated by solving the time-dependent Schrodinger equation. The sum of V-V, T, and V-V, R contributions shows very weak temperature dependence and is in reasonable agreement with observed data over the temperature range 300-3000 K.

Temperature Dependence of the Rate Constants of the VV Energy Exchange for N$_2$(v=1)+O$_2$(v=0)$\rightarrow$N$_2$(v=0)+O$_2$(v=1)

  • Ree, Jong-Baik;Chung, Keun-Ho;Kim, Hae-Jin
    • Bulletin of the Korean Chemical Society
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    • v.7 no.3
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    • pp.241-245
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    • 1986
  • The vibration-vibration energy exchange of $N_2(v=1)+O_2(v=0){\to}N_2(v=0)+O_2(v=1)$ has been investigated, in particular, at low temperatures. The energy exchange rate constants are calculated by use of the solution of the time-dependent Schrodinger equation with the interaction potential of the colliding molecule as a perturbation term. The predicted rate constants are significantly agree with a experimental values in the range of 295∼$90^{\circ}K$. The consideration of the VV-VT coupling decreases the predicted pure VV energy exchange value by a factor of ∼2. When the collision frequency correction is introduced, the VV-VT rate constant is consistent with the observed value in the liquid phase. The consideration of the population of the rotational energy level increases the VV-VT value significantly.

EXISTENCE OF A POSITIVE SOLUTION TO INFINITE SEMIPOSITONE PROBLEMS

  • Eunkyung Ko
    • East Asian mathematical journal
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    • v.40 no.3
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    • pp.319-328
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    • 2024
  • We establish an existence result for a positive solution to the Schrödinger-type singular semipositone problem: $-{\Delta}u\,=\,V(x)u\,=\,{\lambda}{\frac{f(u)}{u^{\alpha}}}$ in Ω, u = 0 on ∂Ω, where Ω is a bounded domain in ℝN , N > 2, λ ∈ ℝ is a positive parameter, V ∈ L(Ω), 0 < α < 1, f ∈ C([0, ∞), ℝ) with f(0) < 0. In particular, when ${\frac{f(s)}{s^{\alpha}}}$ is sublinear at infinity, we establish the existence of a positive solutions for λ ≫ 1. The proofs are mainly based on the sub and supersolution method. Further, we extend our existence result to infinite semipositone problems with mixed boundary conditions.

Active Layer Simulation for the Tolerance of Epi-layer Thickness at CaAs/AlGaAs 3-Quantum Well Quantum Cascade Lasers (GaAs/AlGaAs 3-Quantum Well 양자폭포레이저 (Quantum Cascade Lasers)에서 허용되는 에피정밀도를 위한 활성영역 모의실험)

  • Lee, Hye-Jin;Lee, Cheng-Ming;Han, Il-Ki;Lee, Jung-Il;Kim, Moon-Deock
    • Journal of the Korean Vacuum Society
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    • v.16 no.4
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    • pp.273-278
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    • 2007
  • For the simulation of active region in the quantum cascade lasers (QCL), we solved Schrodinger equation utilizing Runge-Kutta method and Shotting method. Wavelength, phonon resonant energy, and dipole matrix element were simulated with the variation of active region thickness. As a result of such simulation, it was suggested the tolerance range of epi-layer thickness error when 3-quantum well QCL structures are grown.

Molecular dynamics studies of interaction between hydrogenand carbon nano-carriers

  • Wang, Yun-Che;Wu, Chun-Yi;Chen, Chi;Yang, Ding-Shen
    • Coupled systems mechanics
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    • v.3 no.4
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    • pp.329-344
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    • 2014
  • In this work, quantum molecular dynamics simulations (QMD) are preformed to study the hydrogen molecules in three types of carbon nanostructures, $C_{60}$ fullerene, (5,5) and (9,0) carbon nanotubes and graphene layers. Interactions between hydrogen and the nanostructures is of importance to understand hydrogen storage for the development of hydrogen economy. The QMD method overcomes the difficulties with empirical interatomic potentials to model the interaction among hydrogen and carbon atoms in the confined geometry. In QMD, the interatomic forces are calculated by solving the Schrodinger's equation with the density functional theory (DFT) formulation, and the positions of the atomic nucleus are calculated with the Newton's second law in accordance with the Born-Oppenheimer approximation. It is found that the number of hydrogen atoms that is less than 58 can be stored in the $C_{60}$ fullerene. With larger carbon fullerenes, more hydrogen may be stored. For hydrogen molecules passing though the fullerene, a particular orientation is required to obtain least energy barrier. For carbon nanotubes and graphene, adsorption may adhere hydrogen atoms to carbon atoms. In addition, hydrogen molecules can also be stored inside the nanotubes or between the adjacent layers in graphite, multi-layer graphene.

Quantum-Mechanical Modeling and Simulation of Center-Channel Double-Gate MOSFET (중앙-채널 이중게이트 MOSFET의 양자역학적 모델링 및 시뮬레이션 연구)

  • Kim, Ki-Dong;Won, Tae-Young
    • Journal of the Institute of Electronics Engineers of Korea SD
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    • v.42 no.7 s.337
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    • pp.5-12
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    • 2005
  • The device performance of nano-scale center-channel (CC) double-gate (DG) MOSFET structure was investigated by numerically solving coupled Schr$\"{o}$dinger-Poisson and current continuity equations in a self-consistent manner. The CC operation and corresponding enhancement of current drive and transconductance of CC-NMOS are confirmed by comparing with the results of DG-NMOS which are performed under the condition of 10-80 nm gate length. Device optimization was theoretically performed in order to minimize the short-channel effects in terms of subthreshold swing, threshold voltage roll-off, and drain-induced barrier lowering. The simulation results indicate that DG-MOSFET structure including CC-NMOS is a promising candidates and quantum-mechanical modeling and simulation calculating the coupled Schr$\"{o}$dinger-Poisson and current continuity equations self-consistently are necessary for the application to sub-40 nm MOSFET technology.