Revealing the Relationship between Semiconductor Electronic Structure and Electron Transfer Dynamics at Metal Oxide–Chromophore Interfaces

2013 ◽  
Vol 117 (48) ◽  
pp. 25259-25268 ◽  
Author(s):  
Robin R. Knauf ◽  
M. Kyle Brennaman ◽  
Leila Alibabaei ◽  
Michael R. Norris ◽  
Jillian L. Dempsey

Author(s):  
Lars Mohrhusen ◽  
Jessica Kräuter ◽  
Katharina Al-Shamery

The photochemical conversion of organic compounds on tailored transition metal oxide surfaces by (UV) irradiation has found wide applications ranging from the production of chemicals to the degradation of organic...





2008 ◽  
Vol 41 (11) ◽  
pp. 115004 ◽  
Author(s):  
Xingtao Jia ◽  
Wei Yang ◽  
Hong Li ◽  
Minghui Qin


2016 ◽  
Vol 370 ◽  
pp. 279-290 ◽  
Author(s):  
Joshua Minwoo Kweun ◽  
Chenzhe Li ◽  
Yongping Zheng ◽  
Maenghyo Cho ◽  
Yoon Young Kim ◽  
...  


2005 ◽  
Vol 33 (1) ◽  
pp. 20-21 ◽  
Author(s):  
M. Sundararajan ◽  
J.P. McNamara ◽  
M. Mohr ◽  
I.H. Hillier ◽  
H. Wang

We describe the use of the semi-empirical molecular orbital method PM3 (parametric method 3) to study the electronic structure of iron–sulphur proteins. We first develop appropriate parameters to describe models of the redox site of rubredoxins, followed by some preliminary calculations of multinuclear iron systems of relevance to hydrogenases.



2018 ◽  
Vol 119 ◽  
pp. 111-118 ◽  
Author(s):  
Matthew D. Yates ◽  
Brian J. Eddie ◽  
Nikolai Lebedev ◽  
Nicholas J. Kotloski ◽  
Sarah M. Strycharz-Glaven ◽  
...  






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