Surface for methane combustion: O(3P) +CH4 → OH+CH3
O(3P) + CH4(X1A1) reaction path obtained at the all-electron CCSD(T)/optACVQZ level. The energy of the reactants is set as zero.
Surface for methane combustion: O(3P) +CH4 → OH+CH3 |
O(3P) + CH4(X1A1) reaction path obtained at the all-electron CCSD(T)/optACVQZ level. The energy of the reactants is set as zero. |
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