Jump to Main Content
- Sun, Sutao, et al. Show all 4 Authors
- Journal of physical chemistry 2019 v.123 no.47 pp. 28569-28575
- acoustics; electric current; electric field; models; molecular dynamics; polymers; spectral analysis
- ... To understand the dynamic properties of polaron in conjugated polymers, we have investigated various spectra of electric current density, charge density, and lattice vibrations of acoustic and optic modes based on the Su–Schrieffer–Heeger model, by using nonadiabatic molecular dynamics and power-spectrum density methods. A series of characteristic peaks have been identified. In the spectrum of cur ...