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1 . Academic Journal
An extensive methodological theoretical study of the kinetics of the benzylperoxy radical isomerization
저자
by
Canneaux, Sébastien
;
Hammaecher, Catherine
;
Ribaucour, Marc
.
소스
In
Computational and Theoretical Chemistry
15 December 2012 1002:64-70
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5 . Academic Journal
Ab initio calculations and iodine kinetic modeling in the reactor coolant system of a pressurized water reactor in case of severe nuclear accident
저자
by
Xerri, Bertrand
;
Canneaux, Sébastien
;
Louis, Florent
;
Trincal, Julien
;
Cousin, Frédéric
, et al.
소스
In
Computational and Theoretical Chemistry
15 June 2012 990:194-208
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7 . Academic Journal
Molecular structures and thermodynamic properties of 12 gaseous cesium-containing species of nuclear safety interest: Cs 2, CsH, CsO, Cs 2O, CsX, and Cs 2X 2 (X = OH, Cl, Br, and I)
저자
by
Badawi, Michael
;
Xerri, Bertrand
;
Canneaux, Sébastien
;
Cantrel, Laurent
;
Louis, Florent
.
소스
In
Journal of Nuclear Materials
2012 420(1):452-462
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7 . Academic Journal
A theoretical study of the NCN ( 3Σ −) biradical thermochemical properties: Implications for combustion chemistry
저자
by
Canneaux, Sébastien
;
Wallet, Adrien
;
Ribaucour, Marc
;
Louis, Florent
.
소스
In
Computational and Theoretical Chemistry
2011 967(1):67-74
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6 . Academic Journal
Atmospheric reactivity of CH 3I and CH 2I 2 with OH radicals: A comparative study of the H- versus I-abstraction
저자
by
Louis, Florent
;
Černušák, Ivan
;
Canneaux, Sébastien
;
Mečiarová, Katarína
.
소스
In
Computational and Theoretical Chemistry
2011 965(2):275-284
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6 . Academic Journal
A theoretical study of the kinetics of the forward and reverse reactions HI + CH 3 = I + CH 4
저자
by
Mečiarová, Katarína
;
Šulka, Martin
;
Canneaux, Sébastien
;
Louis, Florent
;
Černušák, Ivan
.
소스
In
Chemical Physics Letters
2011 517(4):149-154
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7 . Academic Journal
Accommodation of ethanol, acetone and benzaldehyde by the liquid–vapor interface of water: A molecular dynamics study
저자
by
Canneaux, Sébastien
;
Soetens, Jean-Christophe
;
Henon, Eric
;
Bohr, Frédéric
.
소스
In
Chemical Physics
2006 327(2):512-517
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6 . Academic Journal
TheoreticalStudy of the Oxidation Mechanisms of Naphthalene Initiated by HydroxylRadicals: The OH-Addition Pathway.
저자
by
Shiroudi, Abolfazl
;
Deleuze, Michael S.
;
Canneaux, Sébastien
.
소스
Journal of Physical Chemistry A
. Jul2014, Vol. 118 Issue 26, p4593-4610. 18p.
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5 . Academic Journal
KiSThelP: A program to predict thermodynamic properties and rate constants from quantum chemistry results
†
.
저자
by
Canneaux, Sébastien
;
Bohr, Frédéric
;
Henon, Eric
.
소스
Journal of Computational Chemistry
. Jan2014, Vol. 35 Issue 1, p82-93. 13p.
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5 . Academic Journal
Theoretical Study of H-AbstractionReactions fromCH3Cl and CH3Br Molecules by ClO and BrO Radicals.
저자
by
Canneaux, Sébastien
;
Hammaecher, Catherine
;
Cours, Thibaud
;
Louis, Florent
;
Ribaucour, Marc
.
소스
Journal of Physical Chemistry A
. May2012, Vol. 116 Issue 17, p4396-4408. 13p.
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