Development of broken-symmetry (BS) methods in chemical reactions. A theoretical view of water oxidation in photosystem II and related systems
Kizashi Yamaguchi, Hiroshi Isobe, Mitsuo Shoji, Koichi Miyagawa, Shusuke Yamanaka, Takashi Kawakami, Takahito Nakajima
Topics & Concepts
ChemistryPhotosystem IIAtomic orbitalReactivity (psychology)Oxygen-evolving complexPhotochemistryRadical ionHOMO/LUMOPhotosynthetic reaction centreComputational chemistryElectron transferIonMoleculeElectronPhotosynthesisOrganic chemistryQuantum mechanicsPathologyMedicinePhysicsBiochemistryAlternative medicinePhotosynthetic Processes and MechanismsMetal-Catalyzed Oxygenation MechanismsSpectroscopy and Quantum Chemical Studies