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An explicit density matrix functional of the (N – 1)-particle system when the N-particle system is known

✍ Scribed by Robert C. Morrison


Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
345 KB
Volume
36
Category
Article
ISSN
0020-7608

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Metal and ligand hyperfine couplings of a previously suggested, energetically feasible Mn(4)Ca model cluster (SG2009(-1)) for the S(2) state of the oxygen-evolving complex (OEC) of photosystem II (PSII) have been studied by broken-symmetry density functional methods and compared with other suggested