Advanced characterization and calculation methods for rechargeable battery materials in multiple scales |
The schematics of asymmetric 48Z_SI(l, m, n) networks and the corresponding band structures. (a) Three-wing GNRs building block of asymmetric CFs and three width degrees of freedom, l, m, n, are considered. (b) and (c) m = n and m ≠ n asymmetric CFs, respectively. The orange and cyan sticks indicate the sp3 and sp2 C atoms, respectively. (d) The band structures of (5, 3, 2), (5, 3, 3), (5, 4, 2), (5, 4, 3), (5, 4, 4), (5, 5, 2), (5, 5, 3), (5, 5, 4), and (5, 6, 6).[ |