Dynamics and decay rates of a time-dependent two-saddle system

被引:3
|
作者
Reiff, Johannes [1 ]
Feldmaier, Matthias [1 ]
Main, Joerg [1 ]
Hernandez, Rigoberto [2 ,3 ,4 ]
机构
[1] Univ Stuttgart, Inst Theoret Phys 1, D-70550 Stuttgart, Germany
[2] Johns Hopkins Univ, Dept Chem, Baltimore, MD 21218 USA
[3] Johns Hopkins Univ, Dept Chem & Bimol Engn, Baltimore, MD 21218 USA
[4] Johns Hopkins Univ, Dept Mat Sci & Engn, Baltimore, MD 21218 USA
基金
欧盟地平线“2020”; 美国国家科学基金会;
关键词
TRANSITION-STATE THEORY; UNIFIED STATISTICAL-MODEL; OSCILLATING BARRIERS; ROAMING TRAJECTORIES; KETENE ISOMERIZATION; ENERGY-DEPENDENCE; COMPLEX; HIERARCHY; ESCAPE;
D O I
10.1103/PhysRevE.103.022121
中图分类号
O35 [流体力学]; O53 [等离子体物理学];
学科分类号
070204 ; 080103 ; 080704 ;
摘要
The framework of transition state theory (TST) provides a powerful way for analyzing the dynamics of physical and chemical reactions. While TST has already been successfully used to obtain reaction rates for systems with a single time-dependent saddle point, multiple driven saddles have proven challenging because of their fractal-like phase space structure. This paper presents the construction of an approximately recrossing-free dividing surface based on the normally hyperbolic invariant manifold in a time-dependent two-saddle model system. Based on this, multiple methods for obtaining instantaneous (time-resolved) decay rates of the underlying activated complex are presented and their results discussed.
引用
收藏
页数:11
相关论文
共 50 条
  • [1] Transcriptional dynamics with time-dependent reaction rates
    Nandi, Shubhendu
    Ghosh, Anandamohan
    PHYSICAL BIOLOGY, 2015, 12 (01)
  • [2] Decay rates of solutions to Euler equations with time-dependent damping
    Zhang, Lina
    NONLINEAR ANALYSIS-REAL WORLD APPLICATIONS, 2020, 54
  • [3] Time-dependent invariant sets in system dynamics
    Pastravanu, Octavian
    Matcovschi, Mihaela-Hanako
    Voicu, Mihail
    PROCEEDINGS OF THE 2006 IEEE INTERNATIONAL CONFERENCE ON CONTROL APPLICATIONS, VOLS 1-4, 2006, : 1442 - 1447
  • [4] THE DECAY TIME OF THE TIME-DEPENDENT TRANSIENT STOCHASTIC DYNAMICS, IN PRESENCE OF AN EXTERNAL FORCE
    JIMENEZAQUINO, JI
    OPTICS COMMUNICATIONS, 1995, 114 (5-6) : 501 - 508
  • [5] Deformation dependence of proton decay rates and angular distributions in a time-dependent approach
    Carjan, N
    Talou, P
    Strottman, D
    ENAM 98: EXOTIC NUCLEI AND ATOMIC MASSES, 1998, 455 : 282 - 285
  • [6] Vacuum decay in time-dependent backgrounds
    Draper, Patrick
    Karydas, Manthos
    Zhang, Hao
    PHYSICAL REVIEW D, 2023, 108 (09)
  • [7] On the time-dependent analysis of Gamow decay
    Duerr, Detlef
    Grummt, Robert
    Kolb, Martin
    EUROPEAN JOURNAL OF PHYSICS, 2011, 32 (05) : 1311 - 1321
  • [8] Experimental test of the fluctuation theorem for a driven two-level system with time-dependent rates
    Schuler, S
    Speck, T
    Tietz, C
    Wrachtrup, J
    Seifert, U
    PHYSICAL REVIEW LETTERS, 2005, 94 (18)
  • [9] Time-dependent analysis for a two-processor heterogeneous system with time-varying arrival and service rates
    Ammar, Sherif I.
    Alharbi, Yousef F.
    APPLIED MATHEMATICAL MODELLING, 2018, 54 : 743 - 751