25 research outputs found
Rates and energetics of intramolecular electron transfer processes in conjugated metallofullerenes
No full textAn endohedral metallofullerene as a pure electron donor: Intramolecular electron transfer in donor-acceptor conjugates of La2@C80 and 11,11,12,12-tetracyano-9,10-anthra- p -quinodimethane (TCAQ)
No full textSynthesis and charge-transfer chemistry of La2@I h-C80/Sc3N@Ih-C80-zinc porphyrin conjugates: Impact of endohedral cluster
No full textIntramolecular versus intermolecular electronic interactions between [5,6]-open and [6,6]-closed C60 adducts with exTTF
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Stabilizing ion and radical ion pair states in a paramagnetic endohedral metallofullerene/Ï-extended tetrathiafulvalene conjugate
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Superoxide dismutase in human adrenal and its disorders: A correlation with development and neoplastic changes
No full textStandard enthalpies of formation of finite-length (5,5) single-walled carbon nanotube
No full textStandard enthalpies of formation (Delta H-f(0)) of finite-length ( 5, 5) single- walled carbon nanotubes ( SWNTs) are calculated with the framework of density functional theory. Approximate expressions of (Delta H-f(0)) have been proposed for both H-terminated and C30- capped ( 5, 5) SWNTs, based upon which the calculated values of (Delta H-f(0)) have been reproduced within several kilocalories per mole. It is also found that standard enthalpies of formation contributed by per carbon, Delta H-f(0) (C), oscillate with the increment of the cluster size, suggesting the dependence of the relative stability on the axial length
