Photodissociation spectrum of cyanobenzene dimer cation. Absence of intermolecular resonance interaction
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چکیده
منابع مشابه
Spectrum and vibrational predissociation of the HF dimer. II. Photodissociation cross sections and product state distributions
We study vibrational predissociation of the HF dimer both by a full coupled channels treatment as well as in the Fermi golden rule approximation. Photodissociation cross sections, linewidths, and rotational state distributions are computed for excitations from the ground state with rotational quantum numbers J51, K50 to monomer stretch excited states with J5K50, both for even and odd permutatio...
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Ammonia-water cation and ammonia dimer cation.
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متن کاملElectromers of the benzene dimer radical cation.
The well-studied benzene dimer radical cation, which is prototypical for this class of species, has been reinvestigated computationally. Thereby it turned out that both the σ-hemibonded and the half-shifted sandwich structures of the benzene dimer cation, which had been independently proposed, represent stationary points on the B2PLYP-D potential energy surfaces. However, these structures belon...
متن کاملElectronic structure of the benzene dimer cation.
The benzene and benzene dimer cations are studied using the equation-of-motion coupled-cluster model with single and double substitutions for ionized systems. The ten lowest electronic states of the dimer at t-shaped, sandwich, and displaced sandwich configurations are described and cataloged based on the character of the constituent fragment molecular orbitals. The character of the states, bon...
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ژورنال
عنوان ژورنال: Research on Chemical Intermediates
سال: 1998
ISSN: 0922-6168,1568-5675
DOI: 10.1163/156856798x00393