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List of works by Kizashi Yamaguchi

An oxyl/oxo mechanism for oxygen-oxygen coupling in PSII revealed by an x-ray free-electron laser

scientific article published on 17 October 2019

Electronic and spin structures of CaMn4Ox clusters in the S0 state of the oxygen evolving complex of photosystem II. Domain-based local pair natural orbital (DLPNO) coupled-cluster (CC) calculations using optimized geometries and natural orbitals (U

scientific article published on 23 November 2020

Origin of the enhancement of the second hyperpolarizability of singlet diradical systems with intermediate diradical character

scientific article published in August 2006

Preparation and Magnetic Properties of Mn(hfac)2-Complexes of 2-(5-Pyrimidinyl)- and 2-(3-Pyridyl)-Substituted Nitronyl Nitroxides ⬇️

scientific article published on May 19, 2003

Second hyperpolarizabilities of singlet polycyclic diphenalenyl radicals: effects of the nature of the central heterocyclic ring and substitution to diphenalenyl rings.

scientific article published on 28 August 2007

Second hyperpolarizability (gamma) of singlet diradical system: dependence of gamma on the diradical character.

scientific article published in February 2005

Similarities of artificial photosystems by ruthenium oxo complexes and native water splitting systems ⬇️

scientific article published on July 3, 2012

Theoretical and computational investigations of geometrical, electronic and spin structures of the CaMn4 OX (X = 5, 6) cluster in the Kok cycle Si (i = 0-3) of oxygen evolving complex of photosystem II

scientific article published on 04 April 2019

Theoretical illumination of water-inserted structures of the CaMn4O5 cluster in the S2 and S3 states of oxygen-evolving complex of photosystem II: full geometry optimizations by B3LYP hybrid density functional ⬇️

scientific article published on 04 October 2012

Theoretical study on the second hyperpolarizabilities of phenalenyl radical systems involving acetylene and vinylene linkers: diradical character and spin multiplicity dependences

scientific article published on 17 April 2007

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