Molecular isomer effects in ionization and fragmentation of PAH monomers and clusters: pyrene and fluoranthene

被引:0
|
作者
Seitz, F. [1 ]
Holm, A. I. S. [1 ]
Zettergren, H. [1 ]
Johansson, H. A. B. [1 ]
Rosen, S. [1 ]
Schmidt, H. T. [1 ]
Lawicki, A. [2 ]
Rangama, J. [2 ]
Rousseau, P. [2 ]
Capron, M. [2 ]
Maisonny, R. [2 ]
Adoui, L. [2 ]
Mery, A. [2 ]
Manil, B. [3 ]
Huber, B. A. [2 ]
Cederquist, H. [1 ]
机构
[1] Stockholm Univ, Dept Phys, S-S10691 Stockholm, Sweden
[2] Univ Caen, CNRS, ENSICAEN, GEA, F-140705 Caen, France
[3] Univ Paris 13, CNRS, Inst Galile, Phys Lasers Lab, E-93430 Villetaneuse, France
关键词
D O I
10.1088/1742-6596/388/10/102061
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
We have investigated collisions between Xe20+ ions and the isolated polycyclic aromatic hydrocarbon (PAH) C16H10 isomers pyrene and fluoranthene or pure clusters of either pyrene or fluoranthene. We show fragment distributions and intensities for both cases and rationalize the results by means of a classical over-the-barrier (COB) model in conjunction with quantum chemistry calculations of vertical ionization energies of pyrene and fluoranthene monomers. We find that comparatively small differences in the first and second ionization energies for these isomers have significant effects on both the monomer and cluster fragment distributions.
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