First-principles studies of the structural and electronic properties of poly-para-phenylene vinylene
(2004)
Journal Article
Zheng, G., Clark, S., Brand, S., & Abram, R. (2004). First-principles studies of the structural and electronic properties of poly-para-phenylene vinylene. Journal of Physics: Condensed Matter, 16(47), 8609-8620. https://doi.org/10.1088/0953-8984/16/47/013
We present first-principles investigations of the structural and electronic properties of PPV in both the isolated chain and the crystalline state. The calculations are mainly based on the local density approximation within density functional theory.... Read More about First-principles studies of the structural and electronic properties of poly-para-phenylene vinylene.