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Computer-aided Design of Bio-inspired Catalysts for Solar Hydrogen Production

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thesis
posted on 03.04.2019, 23:47 by SIYAO QIU
In this thesis, density functional theory (DFT) calculations have been carried out for the understanding of the hydrogen evolution reaction (HER) on hydrogenase enzymes and the bio-inspired molecular catalysts.

History

Campus location

Australia

Principal supervisor

Chenghua Sun

Additional supervisor 1

Douglas R. MacFarlane

Year of Award

2018

Department, School or Centre

Chemistry

Course

Doctor of Philosophy

Degree Type

DOCTORATE

Faculty

Faculty of Science

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