DFT/TD-DFT investigation on the photoinduced electron transfer of diruthenium and viologen complexes
Malinee Promkatkaew, Songwut Suramitr, Thitinun Karpkird, Masahiro Ehara, Supa Hannongbua
Topics & Concepts
ViologenDicationChemistryRutheniumPhotochemistryElectron transferDensity functional theoryExcited stateRadical ionPolarizable continuum modelAcetonitrileBipyridineMoleculeCrystallographyIonComputational chemistryOrganic chemistryCatalysisPhysicsCrystal structureNuclear physicsSolvationPhotochemistry and Electron Transfer StudiesFree Radicals and AntioxidantsMetal complexes synthesis and properties