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Prof.
 
Stéphane
 
HUMBEL

Prof. Stéphane Humbel's picture
Prof.
Stéphane
HUMBEL
AMU iSm2 Service 561
Campus Scientifique de St Jérôme
13397
Marseille cedex 20


Téléphone
Fax
0491 28 91 79

Sujet de thèse
Valence Bond method with Breathng Orbitals
Parcours

Career path

  • Studies at Orsay university
  • PhD on the Valence Bond method at Orsay university (supervisor P.C. Hiberty) 1992-1995
  • Postdoc on the ONIOM method at Emory university (with K. Morokuma) (1995-1996)
  • Ass. Prof at Reims University between (1996-2002)
  • Prof at Marseille (since 2002)

 

Enseignements

Teaching and related

L1 PC et Bio (Aix) : Atomistique
L2 : Intr. Phys et Chimie Quantique
L3 : Symétrie
M1 Chimie : Laboratoire de modélisation
 

Thématiques

Research topics

Chemical bonding

VB methods

Reaction mechanisms

Electron delocalization

 

Publications (39)
RéférenceRésumé graphique
Valence Bond Approach of Metal Ligand Bonding in the Dewar-Chatt-Duncanson Model

M. Linares, B. Braïda, S. Humbel Inorg. Chem 2007, 46, 11390-11396
Quantifying pi Effects Through a Lewis Valence Bond Approach: Application to Haloallyl and carbonyl Cations

M. Linares, B. Braïda, S. Humbel Faraday Discussions 2007, 135, 273-283.
Reactivity of Dialkylzirconium Species and Solvent Polarity

E. Derat, J. Bouquant, P. Bertus, J. Szymoniak, S. Humbel Int. J. Quant. Chem. 2006, 106, 704-711
Lewis-Based Valence Bond Scheme: Application to the Allyl Cation

M. Linares, B. Braïda, S. Humbel J. Phys. Chem. A 2006, 110, 2505-2509.
Theoretical study of the semi-hydrogenation of alkynes catalyzed by Pd(0) complexes: Is a zwitterionic pathway possible?

A. Dedieu, S. Humbel, C.J. Elsevier, C. Grauffel Theor. Chem. Acc. 2004, 112(4), 305-312.
Hydrometalation or Condensation in the Reaction of Cl2ZrEt2 with H2CO. A Theoretical Account.

E. Derat, J. Bouquant, P. Bertus, J. Szymoniak, S. Humbel, Organometallics 2004, 23, 2892-2899
Configurational Stability of Chlorophosphines,

S. Humbel, C. Bertrand, C. Darcel, C. Bauduin, S. Jugé Inorg. Chem. 2003, 42, 420-427.
On the Link Atom Distance in the ONIOM Scheme, An Harmonic Approximation Analysis

E. Derat, J. Bouquant and S. Humbel, J. Mol. Struct. Theochem 2003, 632, 61-69.
Trans-Bis-[(-)ephedrinate]-palladiumII Complex: Synthesis and Molecular Modeling

S. Bouquillon, S. Humbel, F. Hénin, and J. Muzart, J. Organomet. Chem. 2003, 687, 377-383.

Pages

Communications orales et par affiche (1)
RéférenceRésumé graphique
Yannick Carissan, Denis Hagebaum-Reignier, Nicolas Goudard, Stéphane Humbel. HuLiS a program to recast molecular orbital wave functions into Lewis structures. 5th International Conference on Mathematical Modeling in Physical Sciences, May 2016, Athènes, Greece. Proceedings, 5th International Conference on Mathematical Modeling in Physical Sciences (IC-MSQUARE 2016) (ICMSQ 16) : Athens, Greece, May 23-26, 2016. 〈hal-01408046〉