课题基金 / 基金详情

Dynamics and chaos of molecules

Dynamics and chaos of molecules
分子动力学和混沌
批准号:
11166214
负责人:
TAKATSUKA Kazuo
金额:
$24.58万
依托单位:
依托单位国家:
日本
项目类别:
Grant-in-Aid for Scientific Research on Priority Areas (A)
财政年份:
1999
资助国家:
日本
项目状态:
已结题
起止时间:
1999 至 2001

项目摘要

项目成果

TAKATSUKA Kazuo的其他基金

相关文献

中文摘要
翻译
点击翻译按钮获取中文摘要
英文摘要
Recently, Takatsuka [1] has proposed a modified semiclassical correlation function that is free of the annoying amplitude factor. We refer this function to the amplitude-free correlation function (AFC), which is written in terms of the Action Decomposed Function [2], AFC is composed of only what we call turn-back orbits. Calculation of the turn-back orbits is by far easier than the periodic orbits. The role of the turn-back orbits in describing a standing wave is physically understandable. As an analogy, one may think of the motion of a string, one of the ends of which is spatially fixed on a wall and the other end is shaken. If the phases of ingoing and outcoming waves reflecting at t = 0 match with each other, they should form a stationary state. Here in this talk, we numerically verify that this theory gives really accurate spectrum in a unified manner both to integrable and nonintegrable systems by showing numerically how the AFC actually reproduces the correct eigenvalues of strongly chaotic systems [3]. This epoch-making method can be readily applied to large systems that could not be quantized otherwise.
期刊论文(19)
专著(0)
科研奖励(0)
会议论文
H. Fujisaki, and K. Takatsuka: "Highly Excited Vibronic Eigenfunctions in a Multimode Nonadiabatic System with Duschinsky Rotation"J. Chem. Phys.. 114. 3497-3507 (2001)
H. Fujisaki 和 K. Takatsuka:“具有 Duschinsky 旋转的多模非绝热系统中的高激发电子振动本征函数”J。
DOI: --
发表时间:
期刊:
影响因子: --
作者: []
通讯作者:
H. Ushiyama, and K. Takatsuka: "Successive Mechanism of Double Proton Transfer in Formic Acid Dimer. A Classical Study"J. Chem. Phys.. 115.
H. Ushiyama 和 K. Takatsuka:“甲酸二聚体中双质子转移的连续机制。经典研究”J。
DOI: --
发表时间:
期刊:
影响因子: --
作者: []
通讯作者:
高塚 和夫: "非平衡系の科学IV 分子の複雑性とカオス"講談社サイエンティフィク. 182 (2001)
高冢一夫:“非平衡系统的科学 IV:分子复杂性和混沌”讲谈社科学 182 (2001)。
DOI: --
发表时间:
期刊:
影响因子: --
作者: []
通讯作者:
A.Inoue-Ushiyama, and K. Takatsuka: "Semiclassical Quantization of Strongly Chaotic Vibrations in M7-like cluster"Phys. Rev. E.. 64. 056223-056237 (2001)
A.Inoue-Ushiyama 和 K. Takatsuka:“M7 类星团中强混沌振动的半经典量子化”Phys。
DOI: --
发表时间:
期刊:
影响因子: --
作者: []
通讯作者:
19
    Theory of ultrafast process in chemical dynamics
    • 批准号:
      18066004
    • 项目类别:
      Grant-in-Aid for Scientific Research on Priority Areas
    • 资助金额:
      $21.89万
    • 财政年份:
      2006
    • 负责人:
      TAKATSUKA Kazuo
    • 依托单位:
    Theory of Chemistry beyond the Born-Oppenheimer Concept
    • 批准号:
      18105001
    • 项目类别:
      Grant-in-Aid for Scientific Research (S)
    • 资助金额:
      $71.05万
    • 财政年份:
      2006
    • 负责人:
      TAKATSUKA Kazuo
    • 依托单位:
    Basic theories for molecular quantum dynamics
    • 批准号:
      15205003
    • 项目类别:
      Grant-in-Aid for Scientific Research (A)
    • 资助金额:
      $28.87万
    • 财政年份:
      2003
    • 负责人:
      TAKATSUKA Kazuo
    • 依托单位:
    Theoretical study on ultrafast chemical processes in terms of pump-probe photoelectron spectroscopy
    • 批准号:
      11440170
    • 项目类别:
      Grant-in-Aid for Scientific Research (B)
    • 资助金额:
      $9.02万
    • 财政年份:
      1999
    • 负责人:
      TAKATSUKA Kazuo
    • 依托单位: