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Theoretical studies of the atom-dimer polarization transfer

โœ Scribed by Weber, H. G.


Book ID
105197489
Publisher
Springer
Year
1975
Tongue
English
Weight
487 KB
Volume
273
Category
Article
ISSN
1434-601X

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Theoretical studies on the hydrogen atom
โœ Bon-Su Lee; Ikchoon Lee; Chang Hyun Song; Jae Young Choi ๐Ÿ“‚ Article ๐Ÿ“… 1985 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 550 KB

The hydrogen atom transfer reaction between substituted methanes (substituents; H, F, CH3, OH, and CN) and methyl radicals was studied by 4-31G (UHF) calculations using the MINDO/3 geometries. The transition state structures and energy barriers were determined, and variations of the transition state