Dissociation of acetaldehyde in intense laser field: Coulomb explosion or field-assisted dissociation?
- 1. Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080 (China)
Description
Dissociation of acetaldehyde in moderate strong laser field of 1013-1014 W/cm2 was investigated. Singly charged parent ion CH3CHO+ and fragmental ions CH3+, CHO+, C2H4+, O+, CH2CHO+, and H+ were produced by 800 nm laser of 100 fs pulse duration and recorded by time-of-flight mass spectrometer. The CH3+ fragment further dissociated to CH2+, CH+, and C+ ions at higher intensity. Ab initio calculated results show that the singly-, doubly-, and triply charged parent ions are stable. So, the dissociation mechanism was not due to Coulomb explosion of multicharged ion. A field-assisted dissociation (FAD) theory, which assumes that only one bond undergoes dissociation while the rest of the molecular geometry stays unchanged, was employed to treat the dissociation dynamics. Accordingly, the dressed potential energy surfaces of the ground state for the parent and the fragment ions were calculated. Corresponding quasiclassical trajectory calculations show that the bond ruptures take place in the order of C-C, C-O, and C-H, agreeing with the observation. The observed angular dependence and charge distribution of the product ions can also be interpreted by the FAD theory
Additional details
Identifiers
- DOI
- 10.1063/1.1598955;
Publishing Information
- Journal Title
- Journal of Chemical Physics
- Journal Volume
- 119
- Journal Issue
- 11
- Journal Page Range
- p. 5397-5405
- ISSN
- 0021-9606
- CODEN
- JCPSA6
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 35094384
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS; S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- ACETALDEHYDE; CHARGE DISTRIBUTION; DISSOCIATION; GROUND STATES; HYDROGEN IONS 1 PLUS; LASER RADIATION; MASS SPECTRA; MULTICHARGED IONS; PHOTON-MOLECULE COLLISIONS; POTENTIAL ENERGY; PULSED IRRADIATION; SURFACES; TIME-OF-FLIGHT MASS SPECTROMETERS; TIME-OF-FLIGHT METHOD
- Descriptors DEC
- ALDEHYDES; CATIONS; CHARGED PARTICLES; COLLISIONS; DYNAMIC MASS SPECTROMETERS; ELECTROMAGNETIC RADIATION; ENERGY; ENERGY LEVELS; HYDROGEN IONS; IONS; IRRADIATION; MASS SPECTROMETERS; MEASURING INSTRUMENTS; MOLECULE COLLISIONS; ORGANIC COMPOUNDS; PHOTON COLLISIONS; RADIATIONS; SPECTRA; SPECTROMETERS; TIME-OF-FLIGHT SPECTROMETERS
Optional Information
- Notes
- (c) 2003 American Institute of Physics.