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A TDDFT study of the lowest excitation energies of polycyclic aromatic hydrocarbons

Chemical Physics · 2003 · Vol. 292(1) · pp. 11–21
Maja ParacStefan Grimme
Advanced Chemical Physics StudiesPhotochemistry and Electron Transfer StudiesSpectroscopy and Quantum Chemical StudiesTime-dependent density functional theoryChemistrySinglet stateExcited stateExcitationDensity functional theorySinglet fissionMolecular physicsAtomic physicsComputational chemistry
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