Modelling the metal atom positions of the Photosystem II water oxidising complex: a density functional theory appraisal of the 1.9 Å resolution crystal structure
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Petrie, Simon; Gatt, Phillip; Stranger, Robert; Pace, Ronald
Description
Density functional theory (DFT) calculations are reported for a set of model compounds intended to represent the structure of the Photosystem II (PSII) water oxidising complex (WOC) as determined by the recent 1.9 Å resolution single crystal X-ray diffra
Collections | ANU Research Publications |
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Date published: | 2012 |
Type: | Journal article |
URI: | http://hdl.handle.net/1885/18186 |
Source: | Physical Chemistry Chemical Physics |
DOI: | 10.1039/c2cp41020f |
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01_Petrie_Modelling_the_metal_atom_2012.pdf | 3.04 MB | Adobe PDF | Request a copy |
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