PhD student (2014-2017)

E-mail : belzunces@irsamc.ups-tlse.fr

• 2014-2017 PhD in Theoretical Chemistry under the supervision of Fabienne Bessac and Sophie Hoyau at Laboratoire de Chimie et Physique Quantiques (LCPQ, UMR 5626, IRSAMC, Université Paul Sabatier)
• 2012-2014 : Master’s degree in Theoretical Chemistry (Université Paul Sabatier)
  

• Theoretical study of the atrazine pesticide interaction with pyrophyllite and Ca2+-montmorillonite clay surfaces
  Journal of Computational Chemistry, Wiley, 2017, 38 (3), pp.133-143.
  DOI : 10.1002/jcc.24530
  Bastien Belzunces, Sophie Hoyau, Magalie Benoit, Nathalie Tarrat, Fabienne Bessac.
  
  
• Attenuated MP2 with a Long-Range Dispersion Correction for Treating Nonbonded Interactions
  Matthew B. Goldey, Bastien Belzunces, and Martin Head-Gordon
  Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States
  J. Chem. Theory Comput., 2015, 11 (9), pp 4159–4168
  DOI : 10.1021/acs.jctc.5b00509
  

• 2015-2016, 64 hours :
  M1 level :
  Practical work in Nanochemistry (24 hours)
  L3 level :
  Practical work in Atomistic (6 hours)
  L1 level :
  Tutorial classes in Atomistic (10 hours)
  Practical work (12 hours)
  Practical work in chemistry (12 hours)
  

• 2014-2015, 75 hours :
  L3 level :
  Practical work in Atomistic (10 hours)
  Practical work in Thermodynamics/Kinetics (24 hours)
  Tutorial classes in Structure and Reactivity (9 hours)
  L2 level :
  Practical work in spectroscopy (8 hours)
  L1 level :
  Tutorial classes in Atomistic (24 hours)
  

• June 2016 : The 13th ETSF Young Researcher’s Meeting, London :
  
  Pesticide interaction with environmentally important cations : A molecular dynamics and DFT study of metamitron and fenhexamid
  
  
• June 2015 : Groupement de Recherche (GDR) Edifices Moléculaires Isolés et Environnés (EMIE), Biarritz :
  
  Atomic scale simulation for the study of the interaction between pesticides and soil mineral matter
  

• June 2016 : Réseau de Chimie Théorique Français (RCTF), Lyon :
  
  Pesticide interaction with environmentally important cations : A Molecular Dynamics and DFT study of metamitron and fenhexamid
  
  
• TouCAM days 2015 :
  
  Theoretical simulations for the study of the interaction of atrazine, metamitron and fenhexamid with clay minerals
  
  
• April 2015 : 4ème rencontres Chimie Expérimentale - Chimie Théorique :
  
  Atomic scale simulation for the study of the interaction between pesticides and soil mineral matter.