Ab initio evaluation of correlation contributions to the true π‐electron Hamiltonian: Ethylene
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1682094
Reference35 articles.
1. A Semi‐Empirical Theory of the Electronic Spectra and Electronic Structure of Complex Unsaturated Molecules. I.
2. Electron interaction in unsaturated hydrocarbons
3. Zero Differential Overlap in ϕ-Electron Theories
4. Sigma and Pi Changes in Valence States of Pi‐Electron Theory and One‐Center Coulomb Repulsion Parameters
5. Further Significance of the Pariser Method for Evaluation of the One‐Center Electron Repulsion Integral
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