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- W2054659439 abstract "Abstract On the basis of the second-order Jahn-Teller theory and the semiempirical SCF MO method, the ground states of both corannulene and icosahedral C60 are predicted not to undergo any bond distortions accompanied with molecular-symmetry reductions. The π-type electronic spectra for corannulene calculated by using the energetically most favorable geometrical structures obtained by the SCF MO method are in good agreement with experimental data." @default.
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- W2054659439 date "1986-01-01" @default.
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- W2054659439 title "Geometrical structures and spectra of corannulene and icosahedral c60" @default.
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- W2054659439 doi "https://doi.org/10.1016/s0040-4020(01)88105-9" @default.
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