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Journal of Computational Chemistry
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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
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
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
|
February 10, 2011
A regionally contracted multireference configuration interaction method: general theory and results of an incremental version
Sophie Hoyau, Daniel Maynau, Jean-Paul Malrieu
The Journal of Chemical Physics
|
May 17, 2018
Low-lying excited states of model proteins: Performances of the CC2 method versus multireference methods
Nadia Ben Amor, Sophie Hoyau, Daniel Maynau, et al.
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.
The Journal of Physical Chemistry. A
|
May 19, 2018
The Electronic Structure of Beryllium Chains
Ahmad W Huran, Nadia Ben Amor, Stefano Evangelisti, et al.
The Journal of Chemical Physics
|
July 9, 2021
Model protein excited states: MRCI calculations with large active spaces vs CC2 method
Valérie Brenner, Thibaut Véry, Michael W Schmidt, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
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
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
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
|
February 10, 2011
A regionally contracted multireference configuration interaction method: general theory and results of an incremental version
Sophie Hoyau, Daniel Maynau, Jean-Paul Malrieu
The Journal of Chemical Physics
|
May 17, 2018
Low-lying excited states of model proteins: Performances of the CC2 method versus multireference methods
Nadia Ben Amor, Sophie Hoyau, Daniel Maynau, et al.
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.
The Journal of Physical Chemistry. A
|
May 19, 2018
The Electronic Structure of Beryllium Chains
Ahmad W Huran, Nadia Ben Amor, Stefano Evangelisti, et al.
The Journal of Chemical Physics
|
July 9, 2021
Model protein excited states: MRCI calculations with large active spaces vs CC2 method
Valérie Brenner, Thibaut Véry, Michael W Schmidt, et al.
Page
of 1