Description of the ground state wave functions of Ni dithiolenes using sulfur K-edge x-ray absorption spectroscopy

Journal of the American Chemical Society

Volumn 125, Issue 30, 2003, Pages 9158-9169

  Szilagyi, Robert K ^a   Lim, Booyong S ^b   Glaser, Thorsten ^a   Holm, Richard H ^b   Hedman, Britt ^c   Hodgson, Keith O ^a,c   Solomon, Edward I ^a  

^a STANFORD UNIVERSITY   (United States)

^b HARVARD UNIVERSITY   (United States)

^c SLAC NATIONAL ACCELERATOR LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYSIS; ELECTRONIC STRUCTURE; ENZYMES; GROUND STATE; PROBABILITY DENSITY FUNCTION; SULFUR; X RAY SPECTROSCOPY;

LIGANDS;

NICKEL;

LIGAND; METAL COMPLEX; NICKEL COMPLEX; SULFIDE; THIOL DERIVATIVE;

ABSORPTION SPECTROSCOPY; ARTICLE; CALCULATION; DENSITY FUNCTIONAL THEORY; DIPOLE; ENERGY; MEASUREMENT; MOLECULAR DYNAMICS; ROENTGEN SPECTROSCOPY; SPECTROSCOPY;

MODELS, MOLECULAR; NICKEL; SPECTROMETRY, X-RAY EMISSION; SULFUR; TOLUENE;

EID: 0041365835     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja029806k     Document Type: Article

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