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Journal of the Chemical Society. Dalton Transactions

Volumn 42, Issue 21, 2013, Pages 7539-7554

Bridging-hydride influence on the electronic structure of an [FeFe] hydrogenase active-site model complex revealed by XAES-DFT

(6) Leidel, Nils a Hsieh, Chung Hung b Chernev, Petko a Sigfridsson, Kajsa G V a,c Darensbourg, Marcetta Y b Haumann, Michael a

a FREIE UNIVERSITÄT BERLIN (Germany)

b TEXAS A AND M UNIVERSITY (United States)

c LUND UNIVERSITY (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; EMISSION SPECTROSCOPY; EXCITED STATES; HYDRIDES; LIGANDS;

EMISSION SPECTRUMS; NON-RESONANT EXCITATION; REFERENCE COMPOUNDS; RESONANT INELASTIC X-RAY SCATTERING; SPECTRAL CONTRIBUTION; SPECTRAL SIMULATIONS; X-RAY ABSORPTION AND EMISSION SPECTROSCOPY; [FEFE]HYDROGENASES;

IRON COMPOUNDS;

EID: 84877724802 PISSN: 14779226 EISSN: None Source Type: Journal
DOI: 10.1039/c3dt33042g Document Type: Article

Times cited : (31)

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