Molecular wave packet dynamics decelerated by solvent environment: A theoretical approach

被引：3
|
作者：
Thallmair, S. [1 ,2 ]
Kowalewski, M. [1 ,3 ]
Fingerhut, B. P. [1 ,4 ]
Sailer, C. F. [2 ]
de Vivie-Riedle, R. [1 ]
机构：
[1] LMU Munchen, Dept Chem, Butenandtstr 11, D-81377 Munich, Germany
[2] LMU Munchen, LS BioMol Opt, D-80538 Munich, Germany
[3] Uppsala Univ, Dept Informat Technol, S-75105 Uppsala, Sweden
[4] Univ Calif Irvine, Dept Chem, Irvine, CA 92717 USA
来源：
XVIIITH INTERNATIONAL CONFERENCE ON ULTRAFAST PHENOMENA | 2013年 / 41卷
关键词：
D O I：
10.1051/epjconf/20134105043
中图分类号：
O4 [物理学];
学科分类号：
0702 ;
摘要：
We present a new dynamic continuum ansatz to describe the frictional force exerted on moving wave packets in a solvent cage. The solvent interferes on the femtosecond time scale, but decides the reaction outcome.
引用
收藏
页数：3
相关论文
共 50 条
  • [11] Exact wave packet decoherence dynamics in a discrete spectrum environment
    Tu, Matisse W. Y.
    Zhang, Wei-Min
    JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2008, 41 (24)
  • [12] Hamiltonian approach for wave packet dynamics: Beyond Gaussian wave functions
    Pereverzev, Andrey
    Bittner, Eric R.
    PHYSICS LETTERS A, 2009, 373 (26) : 2215 - 2218
  • [13] Wave Packet Molecular Dynamics simulations of hydrogen at mbar pressures
    Knaup, M
    Reinhard, PG
    Toepffer, C
    Zwicknagel, G
    COMPUTER PHYSICS COMMUNICATIONS, 2002, 147 (1-2) : 202 - 204
  • [14] Wave packet dynamics and control in excited states of molecular nitrogen
    Fushitani, Mizuho
    Fujise, Hikaru
    Hishikawa, Akiyoshi
    You, Daehyun
    Saito, Shu
    Luo, Yu
    Ueda, Kiyoshi
    Ibrahim, Heide
    Legare, Francois
    Pratt, Stephen T.
    Eng-Johnsson, Per
    Mauritsson, Johan
    Olofsson, Anna
    Peschel, Jasper
    Simpson, Emma R.
    Carpeggiani, Paolo Antonio
    Ertel, Dominik
    Maroju, Praveen Kumar
    Moioli, Matteo
    Sansone, Giuseppe
    Shah, Ronak
    Csizmadia, Tamas
    Dumergue, Mathieu
    Nandiga Gopalakrishna, Harshitha
    Kuehn, Sergei
    Callegari, Carlo
    Danailov, Miltcho
    Demidovich, Alexander
    Raimondi, Lorenzo
    Zangrando, Marco
    De Ninno, Giovanni
    Di Fraia, Michele
    Giannessi, Luca
    Plekan, Oksana
    Ribic, Primoz Rebernik
    Prince, Kevin C.
    JOURNAL OF CHEMICAL PHYSICS, 2024, 160 (10):
  • [15] Wave packet molecular dynamics simulations of warm dense hydrogen
    Knaup, M
    Reinhard, PG
    Toepffer, C
    Zwicknagel, G
    JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL, 2003, 36 (22): : 6165 - 6171
  • [16] DENSITY-MATRIX APPROACH TO WAVE-PACKET DYNAMICS
    ROSINA, M
    VANLEUVEN, P
    PHYSICAL REVIEW A, 1992, 45 (01) : 64 - 69
  • [17] AN ADIABATIC STATE APPROACH TO ELECTRONICALLY NONADIABATIC WAVE PACKET DYNAMICS
    PARLANT, G
    YARKONY, DR
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1992, : 737 - 749
  • [18] Phonon wave-packet dynamics at semiconductor interfaces by molecular-dynamics simulation
    Schelling, PK
    Phillpot, SR
    Keblinski, P
    APPLIED PHYSICS LETTERS, 2002, 80 (14) : 2484 - 2486
  • [19] Wave packet molecular dynamics simulations of hydrogen under extreme conditions
    Knaup, M
    Zwicknagel, G
    Reinhard, PG
    Toepffer, C
    JOURNAL DE PHYSIQUE IV, 2000, 10 (P5): : 307 - 310
  • [20] Localization constraints in Gaussian wave packet molecular dynamics of nonideal plasmas
    Morozov, I. V.
    Valuev, I. A.
    JOURNAL OF PHYSICS A-MATHEMATICAL AND THEORETICAL, 2009, 42 (21)
12345