Electronic states and molecular orientation of ITIC film*

Project supported by the National Natural Science Foundation of China (Grant Nos. 11374258 and 11079028).

Du Ying-Ying1, Lin De-Qu1, Chen Guang-Hua1, Bai Xin-Yuan1, Wang Long-Xi1, Wu Rui2, Wang Jia-Ou2, Qian Hai-Jie2, Li Hong-Nian1, †
       

(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.