Chemical Structure from Scientific Research

Open access visualization of Chemical Structure, Hole Density, Electron Density, Interchain CT, Excited States
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Hole and electron densities, in blue and red, respectively, for selected interchain CT excited states as indicated in (B). The transition diagrams show the distribution of the hole (bottom) and electron (top) on the two polymers (CHAIN 1, CHAIN 2). The interchain CT character is determined as the percentage of charge transferred from one chain to the other (i.e., 96.47% in C, 99.92% in D, and 0.12% in E).

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