“…The C 70 and C 60 fullerene cages were much larger and much more stable than the C 32 fullerene cage. However, neutral C 32 seems to have a much larger HOMO-LUMO gap value than those of C 70 (1.3 eV) and C 60 (1.6 eV)[30].The EA of C 32 was experimentally reported as ∼2.8 eV[31]. In our theoretical results (DFT/CAM-B3LYP level), EA ad of C 32 fullerene cage was obtained at 3.025 eV.…”
mentioning
confidence: 47%
“…The charges were on twelve atoms and their color was red and its shades. Lin et al [30] 2). All components of μ and β 0 values were calculated as zero.…”
“…The C 70 and C 60 fullerene cages were much larger and much more stable than the C 32 fullerene cage. However, neutral C 32 seems to have a much larger HOMO-LUMO gap value than those of C 70 (1.3 eV) and C 60 (1.6 eV)[30].The EA of C 32 was experimentally reported as ∼2.8 eV[31]. In our theoretical results (DFT/CAM-B3LYP level), EA ad of C 32 fullerene cage was obtained at 3.025 eV.…”
mentioning
confidence: 47%
“…The charges were on twelve atoms and their color was red and its shades. Lin et al [30] 2). All components of μ and β 0 values were calculated as zero.…”
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