English (United Kingdom)

https://curated-unify.zendy.io/wp-json/zendy-region/v1/featured_content/oa?rat=en

https://curated-unify.zendy.io/wp-json/zendy-region/v1/highlighted_journal/

Global: Zendy Tools annual

Presents the keyphrase highlighting as premium feature

Keyphrase Highlighting

Presents the summarisation as premium feature

Summarisation

Insights

Presents the pdf analysis as premium feature

PDF Analysis

Presents the zaia usage as premium feature

ZAIA

Global: Zendy Tools monthly

Global: Zendy Plus monthly

Presents the access of premium content as premium feature

Premium Content

Global: Zendy Plus annual

Global: Zendy Free Plan

We introduce a practical calculation scheme for the description of excitedelectron dynamics in molecular aggregated systems within a locally groupdiabatic Fock representation. This scheme makes it easy to analyze theinteracting time-dependent excitations of local sites in complex systems. Inaddition, light-electron couplings are considered. The present scheme isintended for investigations on the migration dynamics of excited electrons inlight-energy conversion systems. The scheme was applied to two systems: anaphthalene(NPTL)-tetracyanoethylene(TCNE) dimer and a 20-mer circle ofethylene molecules. Through local group analyses of the dynamical electrons, weobtained an intuitive understanding of the electron transfers between themonomers.

A quantum dynamics method for excited electrons in molecular aggregate system using a group diabatic Fock matrix