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Virtual IR absorption (a) and Raman scattering (b) spectra of DTs related to necklaced graphene oxides based on (5, 5) graphene domain: the reference graphene hydride (VII), graphene oxides with 22 oxygen atoms (XIII) as well as 22 hydroxyl (XIV) and 18 carboxyl units (XV) in the circumference. UHF AM1 calculations. Digits mark DTs in accordance with Figure 1 and Table 1. UHF calculations. Two-color plotting is applied to visualize intersected spectral regions.
