Ab initio calculations are used to examine the energetics for the reaction of FO radicals and H,O. Optimized geometries have been calculated for all reactants, transition states, and products at the unrestricted second-order Msller-Plesset perturbation level of theory. Both Msller-Plesset perturbati
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An ab initio study of the reaction pathway between a mitomycin fragment model and ammonia
β Scribed by Anne Marie Sapse; Grace Snyder
- Publisher
- John Wiley and Sons
- Year
- 2009
- Tongue
- English
- Weight
- 394 KB
- Volume
- 22
- Category
- Article
- ISSN
- 0020-7608
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