Electronic structure of Fe-vs. Ru-based dye molecules

Journal of Chemical Physics

Volumn 138, Issue 4, 2013, Pages

  Johnson, Phillip S ^a   Cook, Peter L ^b   Zegkinoglou, Ioannis ^a,c   Garcia Lastra J M ^d,e   Rubio, Angel ^d   Ruther, Rose E ^f,g   Hamers, Robert J ^h   Himpsel, F J ^a  

^a University of Wisconsin Madison   (United States)

^b UNIVERSITY OF WISCONSIN SUPERIOR   (United States)

^c LAWRENCE BERKELEY NATIONAL LABORATORY   (United States)

^d UNIVERSITY OF THE BASQUE COUNTRY UPV EHU   (Spain)

^e TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

^f OREGON STATE UNIVERSITY   (United States)

^g UNIVERSITY OF OREGON   (United States)

^h UNIVERSITY OF WISCONSIN MADISON   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AXIAL LIGAND; BIPYRIDINES; COMPLEX BEHAVIOR; CRYSTAL FIELDS; DYE MOLECULE; FIRST-PRINCIPLES CALCULATION; N LIGANDS; NEGATIVE CHARGE; OXIDATION STATE; PHENANTHROLINES; TRANSITION ENERGY;

BINDING ENERGY; CALCULATIONS; ELECTRONIC STRUCTURE; LIGANDS; PORPHYRINS; X RAY ABSORPTION SPECTROSCOPY;

MOLECULES;

EID: 84873579773     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4788617     Document Type: Article

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