Electron delocalization and dimerization in solid C59N doped C60 fullerene

Electron spin resonance and ab initio electronic structure calculations show an intricate relation between molecular rotation and chemical bonding in the dilute solid solution. The unpaired electron of C59N is delocalized over several C60 molecules above 700 K, while at lower temperatures it remains...

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Vydané v:	Physical review letters Ročník 94; číslo 6; s. 066603.1 - 066603.4
Hlavní autori:	ROCKENBAUER, A, CSANYI, Gabor, FÜLÖP, F, GARAJ, S, KORECZ, L, LUKACS, R, SIMON, F, FORRO, L, PEKKER, S, JANOSSY, A
Médium:	Journal Article
Jazyk:	English
Vydavateľské údaje:	Ridge, NY American Physical Society 18.02.2005
Predmet:	Condensed matter: electronic structure, electrical, magnetic, and optical properties Electron density of states and band structure of crystalline solids Electron states Exact sciences and technology Fullerenes and related materials; intercalation compounds Physics Electronic structure Doping Fullerenes Electron transfer Electron delocalization Ab initio calculations Electron paramagnetic resonance Dimerization
ISSN:	0031-9007
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