Oxidation of hydrocarbons at surface defects: Unprecedented confirmation of the oxomethylidyne pathway on a stepped Rh surface
The pathway of methylidyne (CH) oxidation on Rh{211} was studied using plane wave density functional theory (DFT) slab calculations and microkinetic simulations. We present ample evidence that the direct decomposition and oxidation mechanism is not the main reaction route to sythesis gas especially...
| मुख्य लेखकों: | , , , , |
|---|---|
| स्वरूप: | Journal article |
| भाषा: | English |
| प्रकाशित: |
2008
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