Origin of Rotational Barriers. I. Many‐Electron Molecular Orbital Wavefunctions for Ethane, Methyl Alcohol, and Hydrogen Peroxide
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1841031
Reference26 articles.
1. An Electrostatic Theory of the Potential Barriers Hindering Rotation around Single Bonds
2. Magnitudes of Barriers in Intramolecular Rotation
3. An Approach to the Internal Rotation Problem
4. Distortional Effects on the Ethane Internal‐Rotation Barrier
5. Internal Rotation in Hydrogen Peroxide and Methyl Alcohol: A Simple Electrostatic Model
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3. Rotational barriers: Comparison of semiempirical and Ab initio quantum mechanical calculations;International Journal of Quantum Chemistry;2009-06-18
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