The interaction between the molecules ethylene and cis-NzH2 has been studied using a double-zeta gaussian basis in a series of ab initio SCF calculations. The results obtained indicate that the synchronous hydrogen transfer reaction is a onestep reaction having an activation energy of around 60 kcal
Quantum Chemical Study of the Reaction between Ni+ and H2S
β Scribed by Oier Lakuntza; Dr. Jon M. Matxain; Prof. Dr. Jesus M. Ugalde
- Publisher
- John Wiley and Sons
- Year
- 2010
- Tongue
- English
- Weight
- 291 KB
- Volume
- 11
- Category
- Article
- ISSN
- 1439-4235
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