The synchronous-transit method for determining reaction pathways and locating molecular transition states
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference32 articles.
1. Structure of transition states in organic reactions. General theory and an application to the cyclobutene-butadiene isomerization using a semiempirical molecular orbital method
2. Structure of transition states. III. MINDO/2 study of the cyclization of 1,3,5-hexatriene to 1,3-cyclohexadiene
3. Efficient determination and characterization of transition states using ab-initio methods
4. T.A. Halgren, J. Am. Chem. Soc., to be submitted for publication.
5. MINDO [modified intermediate neglect of differential overlap]/2 study of antiaromatic ("forbidden") electrocyclic processes
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