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• W2023188232 endingPage "8111" @default.
• W2023188232 startingPage "8111" @default.
• W2023188232 abstract "Carbon nanotube junctions can be modeled by fullerene spanning or by using some operations on map. They can self-assemble into more complex structures, such as finite or infinite high genera multi-tori. Four junctions of tetrahedral and octahedral symmetry, covered by patches consisting only of hexagons, were designed. Their stability is discussed in terms of total energy, evaluated at Hartree-Fock (HF) level of theory, HOMO-LUMO gap, strain energy, HOMA index of aromaticity and the Kekulé structure count. Vibrational spectra of these junctions are given as well. A new multi-toroidal structure, of octahedral symmetry, is presented for the first time. The study on topology of the multi-tori herein designed revealed the relation of these structures with the genus of their embedding surface." @default.
• W2023188232 created "2016-06-24" @default.
• W2023188232 creator A5020187585 @default.
• W2023188232 creator A5073892189 @default.
• W2023188232 date "2012-01-01" @default.
• W2023188232 modified "2023-10-18" @default.
• W2023188232 title "Nanotube junctions and the genus of multi-tori" @default.
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• W2023188232 doi "https://doi.org/10.1039/c2cp40696a" @default.
• W2023188232 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/22549433" @default.
• W2023188232 hasPublicationYear "2012" @default.
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