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• W1989803775 abstract "The physicochemical properties of a novel carbon cluster (C16) and C16 beside vitamin C have been evaluated using Density Functional Theory (DFT) calculation. NMR properties are calculated by using density functional method (B3LYP) with 6-31G, 6-311G* and cc-pvdz as the basis sets. Also natural bond orbital (NBO) and thermodynamic analysis has been performed for C16 cluster and C16 beside vitamin C. Our results indicate that Vitamin C can form stable bindings with C16 cluster via oxygen (O) active site. Thus, we arrive at the prediction that the C16 nanocluster can be implemented as a novel material for vitamin C carrier applications." @default.
• W1989803775 created "2016-06-24" @default.
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• W1989803775 date "2014-03-05" @default.
• W1989803775 modified "2023-09-27" @default.
• W1989803775 title "Nano Theoretical Study of a C₁₆Cluster as a Novel Material for Vitamin C Carrier" @default.
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• W1989803775 doi "https://doi.org/10.1080/1536383x.2012.717561" @default.
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