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# General VB theory : | # General VB theory : | ||
− | ## Very short introduction on (E)VB theory: [https://wiki.lct.jussieu.fr/workshop/images/8/8f/Chem._Soc._Rev._2014_Shurki.pdf A. Shurki, E. Derat, A. Barrozo and S. C. L. Kamerlin "How valence bond theory can help you understand your (bio)chemical reaction" Chem. Soc. Rev., 2015,44, 1037 | + | ## Very short introduction on (E)VB theory: [https://wiki.lct.jussieu.fr/workshop/images/8/8f/Chem._Soc._Rev._2014_Shurki.pdf A. Shurki, E. Derat, A. Barrozo and S. C. L. Kamerlin "How valence bond theory can help you understand your (bio)chemical reaction" Chem. Soc. Rev., 2015,44, 1037] |
## Short course on VB theory: [http://wiki.lct.jussieu.fr/workshop/images/d/d5/Introduction_to_VB_theory_Shaik_Hiberty_chapter_8_Popelier.pdf Shaik, S.; Hiberty, P. C. "Modern Ab-Initio Valence Bond Methods Philippe C. Hiberty and Sason Shaik"] | ## Short course on VB theory: [http://wiki.lct.jussieu.fr/workshop/images/d/d5/Introduction_to_VB_theory_Shaik_Hiberty_chapter_8_Popelier.pdf Shaik, S.; Hiberty, P. C. "Modern Ab-Initio Valence Bond Methods Philippe C. Hiberty and Sason Shaik"] | ||
## Book chapter (long) : [http://wiki.lct.jussieu.fr/workshop/images/d/db/Chapter1_Hiberty_Shaik_RewComputChem04.pdf Shaik, S.; Hiberty, P. C. ''Valence Bond Theory, its History, Fundamentals, and Applications. A Primer'' In Rev. Comput. Chem.; Kenny B. Lipkowitz, R. L., Thomas R. Cundari, Ed.; Wiley-VCH: New York, 2004; Vol. 20; pp 1-100] | ## Book chapter (long) : [http://wiki.lct.jussieu.fr/workshop/images/d/db/Chapter1_Hiberty_Shaik_RewComputChem04.pdf Shaik, S.; Hiberty, P. C. ''Valence Bond Theory, its History, Fundamentals, and Applications. A Primer'' In Rev. Comput. Chem.; Kenny B. Lipkowitz, R. L., Thomas R. Cundari, Ed.; Wiley-VCH: New York, 2004; Vol. 20; pp 1-100] |
Version du 28 août 2016 à 16:00
- General VB theory :
- Very short introduction on (E)VB theory: A. Shurki, E. Derat, A. Barrozo and S. C. L. Kamerlin "How valence bond theory can help you understand your (bio)chemical reaction" Chem. Soc. Rev., 2015,44, 1037
- Short course on VB theory: Shaik, S.; Hiberty, P. C. "Modern Ab-Initio Valence Bond Methods Philippe C. Hiberty and Sason Shaik"
- Book chapter (long) : Shaik, S.; Hiberty, P. C. Valence Bond Theory, its History, Fundamentals, and Applications. A Primer In Rev. Comput. Chem.; Kenny B. Lipkowitz, R. L., Thomas R. Cundari, Ed.; Wiley-VCH: New York, 2004; Vol. 20; pp 1-100
- Computational VB methods : Hiberty, P. C.; Shaik, S. A Survey of Recent Developments in Ab Initio Valence Bond Theory, J. Comput. Chem. 2007, 28, 137-151
- Reviews on recent applications :
- Valence Bond diagrams and its applications :
- Shaik, S.; Shurki, A. Valence Bond Diagrams and Chemical Reactivity, Angew. Chem. Int. Ed. 1999, 38, 586-625.
- D. Usharani, W. Lai, C. Li, H. Chen, D. Danovicha and S. Shaik A tutorial for understanding chemical reactivity through the valence bond approach, Chem. Soc. Rev., 2014, 43, 4968
- Lai, W.; Li, C.; Chen, H.; Shaik, S. Hydrogen-Abstraction Reactivity Patterns from A to Y: The Valence Bond Way, Angew. Chem. Int. Ed. 2012, 51, 5556-5578.
- Books :