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Fluorination of copper phthalocyanines: Electronic structure and interface properties

✍ Scribed by Peisert, H.; Knupfer, M.; Schwieger, T.; Fuentes, G. G.; Olligs, D.; Fink, J.; Schmidt, Th.

Book ID
111952685
Publisher
American Institute of Physics
Year
2003
Tongue
English
Weight
489 KB
Volume
93
Category
Article
ISSN
0021-8979

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First-principles electronic structure of
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✍ Yanting Yang; Yanming Yang; Fugen Wu; Zhigang Wei πŸ“‚ Article πŸ“… 2008 πŸ› Elsevier Science 🌐 English βš– 948 KB

Copper phthalocyanine (CuPc), was reported to have high electron mobility. In order to gain a deeper understanding for its carrier transport properties, we adopt the density functional theory (DFT) with generalized gradient approximation (GGA) to calculate the electronic band structure by the Becke