Ontology highlight
ABSTRACT:
SUBMITTER: Li Y
PROVIDER: S-EPMC3556892 | biostudies-literature | 2013
REPOSITORIES: biostudies-literature
Li Yuanzuo Y Cui Jingang J Zhao Jianing J Liu Jinglin J Song Peng P Ma Fengcai F
TheScientificWorldJournal 20130110
Stimulated by a recent experimental report, charge transfer and photophysical properties of donor-acceptor ambipolar polymer were studied with the quantum chemistry calculation and the developed 3D charge difference density method. The effects of electronic acceptor strength on the structure, energy levels, electron density distribution, ionization potentials, and electron affinities were also obtained to estimate the transporting ability of hole and electron. With the developed 3D charge differ ...[more]