Theoretical reconsideration of the mechanism of the excited state proton transfer of indigo carmine in water
Lixia Zhu, Qiao Zhou, Bifa Cao, Bo Li, Zhengran Wang, Xinglei Zhang, Hang Yin, Ying Shi
Topics & Concepts
Intramolecular forceIntermolecular forceHydrogen bondChemistryProtonDensity functional theoryExcited stateMoleculeIndigo carmineWater dimerChemical physicsComputational chemistryPhysical chemistryAtomic physicsStereochemistryOrganic chemistryPhysicsQuantum mechanicsPhotochemistry and Electron Transfer StudiesSpectroscopy and Quantum Chemical StudiesFree Radicals and Antioxidants