Theoretical EXAFS studies of a model of the oxygen-evolving complex of photosystem II obtained with the quantum cluster approach

International Journal of Quantum Chemistry

Volumn 113, Issue 4, 2013, Pages 474-478

  Li, Xichen ^a,b,c   Sproviero, Eduardo M ^d   Ryde, Ulf ^e   Batista, Victor S ^d   Chen, Guangju ^a  

^a BEIJING NORMAL UNIVERSITY   (China)

^b STOCKHOLM UNIVERSITY   (Sweden)

^c STOCKHOLM UNIVERSITY   (Sweden)

^d YALE UNIVERSITY   (United States)

^e LUND UNIVERSITY   (Sweden)

Author keywords

density functional calculations; EXAFS spectroscopy; manganese; oxygen evolving complex; photosynthesis

Indexed keywords

CLUSTER MODELS; ENERGETIC BARRIERS; EXAFS DATA; EXAFS STUDIES; EXTENDED X-RAY ABSORPTION FINE STRUCTURE DATUM; GEOMETRY OPTIMIZATION; LOWER ENERGIES; NATURAL SYSTEMS; OXYGEN-EVOLVING COMPLEXES; PHOTOSYSTEM II; QUANTUM CLUSTERS; QUANTUM MECHANICAL CLUSTERS;

DENSITY FUNCTIONAL THEORY; EXTENDED X RAY ABSORPTION FINE STRUCTURE SPECTROSCOPY; MANGANESE; MANGANESE REMOVAL (WATER TREATMENT); OXYGEN; PHOTOSYNTHESIS; QUANTUM THEORY;

MANGANESE COMPOUNDS;

EID: 84872926422     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.24143     Document Type: Article

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