Towards Accurate Predictions and Mechanistic Understanding of the Catalytic Activity of Transition Metal Oxides
The development of active and inexpensive catalysts is vital for progress in technologies related to efficient energy generation, storage, and utilization. Transition metal oxides (TMOs) make up a significant fraction of current state-of-the-art catalysts for these technologies. Density functional t...
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| Format: | Others |
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Research Showcase @ CMU
2016
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| Online Access: | http://repository.cmu.edu/dissertations/673 http://repository.cmu.edu/cgi/viewcontent.cgi?article=1712&context=dissertations |