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- W1985256472 abstract "The small fullerenes, C36n(n=0,2+,2−) and their heteroanalogues (C30N6, C30B6, C24N12andC24B12) have been investigated at the density functional B3LYP/6-31G* level of theory. The aromaticity of these systems was characterized systematically by using the computed nucleus independent chemical shifts values at the cage center and also at the center of individual rings. The hydrogenation product, C36H36, may be experimentally observable considering the calculated strain energy." @default.
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- W1985256472 date "2000-10-01" @default.
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- W1985256472 title "Fullerenes C36n (n=0,2+,2−) and their B- and N-doped analogues" @default.
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- W1985256472 doi "https://doi.org/10.1016/s0009-2614(00)00916-7" @default.
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