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cond-mat.str-el2002★ 5 cited
Jahn-Teller distortions and excitation energies in C60(n+)
Martin Lueders, Nicola Manini
Based on previously computed parameters for the electron-phonon couplings and the Coulomb exchange, we compute and classify the static Jahn-Teller distortions, i.e. the minima of t…
cond-mat.str-el2002★ 18 cited
Coulomb couplings in positively charged fullerene
Martin Lueders, Andrea Bordoni, Nicola Manini +3
We compute, based on density-functional electronic-structure calculations, the Coulomb couplings in the h_u highest occupied orbital of molecular C60. We obtain a multiplet-average…