Understanding the impact of correlation on bond length alternation in polyenes
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
https://link.springer.com/content/pdf/10.1007/s00214-021-02769-2.pdf
Reference33 articles.
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2. Pople JA, Walmsley SH (1962) Bond alternation defects in long polyene molecules. Mol Phys 5:15–20. https://doi.org/10.1080/00268976200100021
3. Salem L (1966) The molecular orbital theory of conjugated systems. Benjamin In, New York
4. Harris RA, Falicov LM (1969) Self-consistent theory of bond alternation in polyenes: normal state, charge-density waves, and spin-density waves. J Chem Phys 51:5034–5041. https://doi.org/10.1063/1.1671900
5. Tenti L, Giner E, Malrieu J-P, Angeli C (2017) Strongly localized approaches for delocalized systems. I. Ground state of linear polyenes. Comput Theor Chem 1116:102–111. https://doi.org/10.1016/j.comptc.2017.01.021
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