Semiclassical guided optimal control of molecular dynamics
Journal Article
·
· Physical Review. A
- Department of Theoretical Studies, Institute for Molecular Science, Myodaiji, Okazaki 444-8585 (Japan)
An efficient semiclassical optimal control theory applicable to multidimensional systems is formulated for controlling wave packet dynamics on a single adiabatic potential energy surface. The approach combines advantages of different formulations of optimal control theory: quantum and classical on one hand and global and local on the other. Numerical applications to the control of HCN-CNH isomerization demonstrate that this theory can provide an efficient tool to manipulate molecular dynamics of many degrees of freedom by laser pulses.
- OSTI ID:
- 20718666
- Journal Information:
- Physical Review. A, Vol. 72, Issue 4; Other Information: DOI: 10.1103/PhysRevA.72.041401; (c) 2005 The American Physical Society; Country of input: International Atomic Energy Agency (IAEA); ISSN 1050-2947
- Country of Publication:
- United States
- Language:
- English
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