Abstract
Arguments are put forward that the active ∝-oxygen site in the Fe-ZSM-5 catalyst consists of the FeO
| Original language | English |
|---|---|
| Pages (from-to) | 3866-3880 |
| Journal | Inorganic Chemistry |
| Issue number | 49 |
| DOIs | |
| Publication status | Published - 2010 |
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Rosa, A., Ricciardi, G., & Baerends, E. J. (2010). Is [FeO]2+ the active center also in iron containing zeolites? A density functional theory study of methane hydroxylation catalysis by Fe-ZSM-5 zeolite. Inorganic Chemistry, (49), 3866-3880. https://doi.org/10.1021/ic1000073