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Journal de Physique 39, 6 (1978) 711-717
Band structure of TTF-TCNQ
S. Shitzkovsky, M. Weger, H. Gutfreund
(1978)

The band structure, the shape of the Fermi surface, and the electronic density of states of TTF-TCNQ are calculated by the LCAO method, for various reasonable values of the effective transfer integrals, for a case in which the intra-chain scattering can be neglected. The integral in the [111] direction is shown to have a drastic effect.
Physics/Physics archives
band structure – electronic density of states – Fermi surface – LCAO calculations – one dimensional conductivity – organic compounds
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