Electronic states and molecular orientation of ITIC film Project supported by the National Natural Science Foundation of China (Grant Nos. 11374258 and 11079028). |
(color online) (a) Optimized structure of ITIC by DFT calculations. The gray, white, red, blue, and yellow balls represent C, H, O, N, and S atoms, respectively. (b) Energy level diagram near HOMO and LUMO levels. |