Multielectron effects on the orientation dependence and photoelectron angular distribution of multiphoton ionization of CO2 in strong laser fields
Creators
- 1. Department of Chemistry, University of Kansas, Lawrence, Kansas 66045 (United States)
- 2. Center for Quantum Science and Engineering, Department of Physics, National Taiwan University, Taipei 10617, Taiwan (China)
Description
We perform an ab initio study of multiphoton ionization (MPI) of carbon dioxide in intense linearly polarized laser pulses with arbitrary molecular orientation by means of a time-dependent density-functional theory (TDDFT) with proper long-range potential. We develop a time-dependent Voronoi-cell finite difference method with highly adaptive molecular grids for accurate solution of the TDDFT equations. Our results demonstrate that the orientation dependence of MPI is determined by multiple orbital contributions and that the electron correlation effects are significant. The maximum peak of MPI is predicted to be at 40 deg. in good agreement with recent experimental data. Photoelectron angular distribution reveals the delicate relation between the orientation dependence and the molecular orbital symmetry.
Additional details
Identifiers
Publishing Information
- Journal Title
- Physical Review. A
- Journal Volume
- 80
- Journal Issue
- 1
- Journal Page Range
- p. 011403-011403.4
- ISSN
- 1050-2947
- CODEN
- PLRAAN
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 41056476
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS; S71: CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS;
- Descriptors DEI
- ANGULAR DISTRIBUTION; CARBON DIOXIDE; DENSITY FUNCTIONAL METHOD; ELECTRON CORRELATION; FINITE DIFFERENCE METHOD; LASER RADIATION; MOLECULAR ORBITAL METHOD; MULTI-PHOTON PROCESSES; ORIENTATION; PHOTOIONIZATION; PHOTON-MOLECULE COLLISIONS; TIME DEPENDENCE; VISIBLE RADIATION
- Descriptors DEC
- CALCULATION METHODS; CARBON COMPOUNDS; CARBON OXIDES; CHALCOGENIDES; COLLISIONS; CORRELATIONS; DISTRIBUTION; ELECTROMAGNETIC RADIATION; IONIZATION; ITERATIVE METHODS; MATHEMATICAL SOLUTIONS; MOLECULE COLLISIONS; NUMERICAL SOLUTION; OXIDES; OXYGEN COMPOUNDS; PHOTON COLLISIONS; RADIATIONS; VARIATIONAL METHODS
Optional Information
- Notes
- (c) 2009 The American Physical Society