A combined theoretical and experimental
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Georg Hvistendahl; Einar Uggerud
📂
Article
📅
1991
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John Wiley and Sons
🌐
English
⚖ 645 KB
Ab initio quantum chemical calculations (MPt/4-31G\*\*) were performed for the dihydrogen elimination reaction from protonated formaldehyde. The energy difference between reactants and products and the activation energies were found to be in good agreement with the corresponding experimental quantit