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Theoretical electron affinities of PAHs and electronic absorption
spectra of their mono-anions, G. Malloci, G. Mulas,
G. Cappellini, V. Fiorentini, I. Porceddu,
Astron. Astrophys. 412, 585-594 (2005)
abstract
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Electronic absorption spectra of PAHs up to vacuum UV.
Towards a detailed model of interstellar PAH photophysics,
G. Malloci, G. Mulas and C. Joblin,
Astron. Astrophys. 426, 105-117 (2004)
abstract
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Electronic absorption spectra of neutral perylene (C20H12),
terrylene (C30H16), and quaterrylene (C40H20) and their positive and
negative ions: Ne matrix-isolation spectroscopy and time-dependent
density functional theory calculations,
T. M. Halasinski, J. L. Weisman, R. Ruiterkamp, T. J. Lee,
F. Salama, M. Head-Gordon,
J. Phys. Chem. A 107, 3660-3669 (2003)
abstract
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Spectroscopy of large PAHs. Laboratory studies and comparison to
the Diffuse Interstellar Bands,
R. Ruiterkamp, T. Halasinski, F Salama, B. H. Foing, L. J.
Allamandola, W. Schmidt, and P. Ehrenfreund,
Astron. Astrophys. 390, 1153-1170 (2002)
abstract
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Density functional theory prediction of the vibrational spectra
of polycyclic aromatic hydrocarbons: effect of molecular
symmetry and size on Raman intensities,
M. Rigolio, C. Castiglioni, G. Zerbi, F. Negri,
J. Mol. Struct. 563-564, 79-87 (2001)
abstract
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Crossover to an even-parity lowest excited singlet in large
oligorylenes: a theoretical study,
S. Karabunarliev, M. Baumgarten, K Mllen,
J. Chem. Phys. 102, 7029-7034 (1998)
abstract
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