Generation of semiclassical and delocalized vibrational wave packet motion of HF molecules oriented in an external static electric field

被引:10
作者
Hervé, S [1 ]
Le Quéré, F [1 ]
Marquardt, R [1 ]
机构
[1] Univ Marne Vallee, Chim Theor Lab, F-77454 Marne la Vallee 2, France
关键词
D O I
10.1063/1.1436114
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The quantum dynamics of the HF molecule is investigated in the presence of a static electric field and coherent infrared radiation. The time dependent dynamics is induced by infrared multiphoton excitation and the time evolution of the rovibrational wave packet is calculated in configuration space. Results are given for static field strengths needed to orient molecules such that their internal dynamics can be described by simplified, purely vibrational models. For highly oriented HF molecules, time intervals of approximate duration of 70 fs occur repeatedly during and after the excitation in which the reduced vibrational wave packet motion is nearly semiclassical ("semiclassical windows"). The occurrence of these time intervals can be made more regular after the excitation, if the pulse duration is chosen adequately. (C) 2002 American Institute of Physics.
引用
收藏
页码:3300 / 3308
页数:9
相关论文
共 59 条
[51]   On the effect of initial rotation on reactivity.: A multi-configuration time-dependent Hartree (MCTDH) wave packet propagation study on the H+D2 and D+H2 reactive scattering systems [J].
Sukiasyan, S ;
Meyer, HD .
JOURNAL OF PHYSICAL CHEMISTRY A, 2001, 105 (12) :2604-2611
[52]   Reexamination of chirped pulse control of wave packet motion in NaI [J].
Tang, H ;
Rice, SA .
JOURNAL OF PHYSICAL CHEMISTRY A, 1997, 101 (50) :9587-9593
[53]  
Van Leuven P, 1998, J PHYS B-AT MOL OPT, V31, P2903, DOI 10.1088/0953-4075/31/13/010
[54]   QUANTUM VERSUS CLASSICAL DYNAMICS IN TREATMENT OF MULTIPLE PHOTON EXCITATION OF ANHARMONIC-OSCILLATOR [J].
WALKER, RB ;
PRESTON, RK .
JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (05) :2017-2028
[55]   Renner-Teller induced photodissociation of HCO in the first absorption band:: Determination of linewidths for the (A)over-tilde2A" K=0,1 states by filter-diagonalization [J].
Weiss, J ;
Schinke, R ;
Mandelshtam, VA .
JOURNAL OF CHEMICAL PHYSICS, 2000, 113 (11) :4588-4597
[56]   A femtosecond midinfrared pump-probe study of hydrogen-bonding in ethanol [J].
Woutersen, S ;
Emmerichs, U ;
Bakker, HJ .
JOURNAL OF CHEMICAL PHYSICS, 1997, 107 (05) :1483-1490
[57]  
Zare R.N., 1988, BAKER LECT SERIES
[58]   RADIATIVE TRANSITION-PROBABILITIES FOR ALL VIBRATIONAL LEVELS IN THE X1-SIGMA+ STATE OF HF [J].
ZEMKE, WT ;
STWALLEY, WC ;
LANGHOFF, SR ;
VALDERRAMA, GL ;
BERRY, MJ .
JOURNAL OF CHEMICAL PHYSICS, 1991, 95 (11) :7846-7853
[59]   FEMTOCHEMISTRY [J].
ZEWAIL, AH .
JOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (48) :12427-12446