Abstract
The ground state spin multiplicity and the geometry of the reductively and oxidatively doped homo- and heteronuclear dendralenes were investigated by means of ab initio calculations. The results were compared with the calculated effective Heisenberg exchange integral for doped infinite dendralenes.
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More From: Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals
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