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- W2886243460 abstract "Scientists are searching for the goal-directed methods to synthesize graphene nanoribbons (GNRs) with a particular edge type and width, which determines their electronic transport properties. A series of Li zigzag GNRs (ZGNRs) with different widths were predicted under high pressure with a stoichiometric ratio of Lin+1C2n, which indicates a route to prepare ultranarrow GNRs. Here, with thermodynamics and ab initio Gibbs free-energy calculations by quasi-harmonic approximation, we investigated the phase stabilities of the Li GNR compounds under high pressure and high temperature. We have also identified Li graphenide LiC2 (n = ∞) and Li polyacenide Li3C4 (n = 2) experimentally at the predicted pressure and temperature conditions using in situ X-ray diffraction, which can be recognized as the two end members of Lin+1C2n with the widest and narrowest ZGNR structures. High temperature and the temperature gradient increased the degree of polymerization and facilitated the formation of wider GNR or carbon slice..." @default.
- W2886243460 created "2018-08-22" @default.
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- W2886243460 date "2018-08-13" @default.
- W2886243460 modified "2023-10-18" @default.
- W2886243460 title "Tailored Synthesis of the Narrowest Zigzag Graphene Nanoribbon Structure by Compressing the Lithium Acetylide under High Temperature" @default.
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- W2886243460 doi "https://doi.org/10.1021/acs.jpcc.8b04081" @default.
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