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Journal of Computational Chemistry
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October 30, 2007
DFT modeling of reactivity in an ionic liquid: How many ion pairs?
Fabienne Bessac, Feliu Maseras
Inorganic Chemistry
|
August 15, 2006
Chemical bonding in phosphane and amine complexes of main group elements and transition metals
Fabienne Bessac, Gernot Frenking
Inorganic Chemistry
|
November 25, 2003
Why is BCl3 a stronger Lewis acid with respect to strong bases than BF3?
Fabienne Bessac, Gernot Frenking
Journal of Computational Chemistry
|
February 22, 2019
Interaction of Metamitron and Fenhexamid with Ca<sup>2+</sup> -Montmorillonite Clay Surfaces: A Density Functional Theory Molecular Dynamics Study
Bastien Belzunces, Sophie Hoyau, Fabienne Bessac
International Journal of Molecular Sciences
|
February 10, 2024
Atrazine Desorption Mechanism from an Hydrated Calcium Montmorillonite-A DFT Molecular Dynamics Study
Quentin Desdion, Fabienne Bessac, Sophie Hoyau
The Journal of Chemical Physics
|
September 24, 2005
Large systems at ab initio multireference level: a cheap treatment thanks to a division into fragments
Fabienne Bessac, Sophie Hoyau, Daniel Maynau
The Journal of Chemical Physics
|
July 13, 2011
Direct selected multireference configuration interaction calculations for large systems using localized orbitals
Nadia Ben Amor, Fabienne Bessac, Sophie Hoyau, et al.
Journal of Computational Chemistry
|
November 19, 2016
Theoretical study of the atrazine pesticide interaction with pyrophyllite and Ca(2+) -montmorillonite clay surfaces
Bastien Belzunces, Sophie Hoyau, Magali Benoit, et al.
Chemosphere
|
July 7, 2014
TyPol - a new methodology for organic compounds clustering based on their molecular characteristics and environmental behavior
Rémi Servien, Laure Mamy, Ziang Li, et al.
The Science of the Total Environment
|
September 25, 2016
Categorizing chlordecone potential degradation products to explore their environmental fate
Pierre Benoit, Laure Mamy, Rémi Servien, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
Journal of Computational Chemistry
|
October 30, 2007
DFT modeling of reactivity in an ionic liquid: How many ion pairs?
Fabienne Bessac, Feliu Maseras
Inorganic Chemistry
|
August 15, 2006
Chemical bonding in phosphane and amine complexes of main group elements and transition metals
Fabienne Bessac, Gernot Frenking
Inorganic Chemistry
|
November 25, 2003
Why is BCl3 a stronger Lewis acid with respect to strong bases than BF3?
Fabienne Bessac, Gernot Frenking
Journal of Computational Chemistry
|
February 22, 2019
Interaction of Metamitron and Fenhexamid with Ca<sup>2+</sup> -Montmorillonite Clay Surfaces: A Density Functional Theory Molecular Dynamics Study
Bastien Belzunces, Sophie Hoyau, Fabienne Bessac
International Journal of Molecular Sciences
|
February 10, 2024
Atrazine Desorption Mechanism from an Hydrated Calcium Montmorillonite-A DFT Molecular Dynamics Study
Quentin Desdion, Fabienne Bessac, Sophie Hoyau
The Journal of Chemical Physics
|
September 24, 2005
Large systems at ab initio multireference level: a cheap treatment thanks to a division into fragments
Fabienne Bessac, Sophie Hoyau, Daniel Maynau
The Journal of Chemical Physics
|
July 13, 2011
Direct selected multireference configuration interaction calculations for large systems using localized orbitals
Nadia Ben Amor, Fabienne Bessac, Sophie Hoyau, et al.
Journal of Computational Chemistry
|
November 19, 2016
Theoretical study of the atrazine pesticide interaction with pyrophyllite and Ca(2+) -montmorillonite clay surfaces
Bastien Belzunces, Sophie Hoyau, Magali Benoit, et al.
Chemosphere
|
July 7, 2014
TyPol - a new methodology for organic compounds clustering based on their molecular characteristics and environmental behavior
Rémi Servien, Laure Mamy, Ziang Li, et al.
The Science of the Total Environment
|
September 25, 2016
Categorizing chlordecone potential degradation products to explore their environmental fate
Pierre Benoit, Laure Mamy, Rémi Servien, et al.
Page
of 2