Full geometry optimizations of the mixed-valence CaMn4O4X(H2O)4(X=OH or O) cluster in OEC of PS II: Degree of symmetry breaking of the labile Mn-X-Mn bond revealed by several hybrid DFT calculations-Reference-Cited by-同舟云学术

Full geometry optimizations of the mixed-valence CaMn4O4X(H2O)4(X=OH or O) cluster in OEC of PS II: Degree of symmetry breaking of the labile Mn-X-Mn bond revealed by several hybrid DFT calculations

Published:2012-04-13 Issue:4 Volume:113 Page:525-541
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Yamaguchi K.,Isobe H.,Yamanaka S.,Saito T.,Kanda K.,Shoji M.,Umena Y.,Kawakami K.,Shen J.-R.,Kamiya N.,Okumura M.

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference63 articles.

1. Manganese Cluster in Photosynthesis: Where Plants Oxidize Water to Dioxygen

2. X-ray spectroscopy-based structure of the Mn cluster and mechanism of photosynthetic oxygen evolution

3. The tetra-manganese complex of photosystem II during its redox cycle – X-ray absorption results and mechanistic implications

4. Calcium EXAFS Establishes the Mn-Ca Cluster in the Oxygen-Evolving Complex of Photosystem II

5. The structure of the manganese complex of Photosystem II in its dark-stable S1-state—EXAFS results in relation to recent crystallographic data

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