Optimizing Oxygen Reduction Catalyst Morphologies from First Principles
Catalytic activity of perovskites for oxygen reduction (ORR) was recently correlated with bulk d-electron occupancy of the transition metal. We expand on the resultant model, which successfully reproduces the high activity of LaMnO[subscript 3] relative to other perovskites, by addressing catalyst s...
| Автори: | , , , , , , , |
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| Інші автори: | |
| Формат: | Стаття |
| Мова: | en_US |
| Опубліковано: |
American Chemical Society (ACS)
2017
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| Онлайн доступ: | http://hdl.handle.net/1721.1/109739 |