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Theoretical study of the valence π→π* excited states of polyacenes: Benzene and naphthalene
T. Hashimoto,
H. Nakano
, K. Hirao
Research output
:
Contribution to journal
›
Article
›
peer-review
127
Citations (Scopus)
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Dive into the research topics of 'Theoretical study of the valence π→π* excited states of polyacenes: Benzene and naphthalene'. Together they form a unique fingerprint.
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Chemistry
Valence
100%
Excited State
83%
Naphthalene
66%
Energy
50%
Benzene
50%
k·p perturbation theory
33%
CASSCF Calculation
33%
Hydrocarbon
33%
Triplet State
33%
Spectra
16%
Symmetry
16%
Ground State
16%
Absorption Spectrum
16%
Electron Correlation
16%
Configuration
16%
Polarization
16%
Orbital
16%