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About the collapse of the 3.3 [mu]m CH stretching band with ionization in polycyclic aromatic hydrocarbons: Configuration interaction and quantum Monte Carlo studies of the CH fragment
Mon, 2010-08-16 20:47 — Anonymous
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Francoise Pauzat, Julien Pilme, Julien Toulouse, and Yves Ellinger The puzzling difference between the IR spectra of polycyclic aromatic hydrocarbons (PAHs) and those of the corresponding positive ions (PAHs) is a well documented fact, although the basic reason for it is far from clear. In this report, the CH fragment, in its neutral and ionized forms is taken as a ... [J. Chem. Phys. 133, 054301 (2010)] published Mon Aug 2, 2010.
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