Theoretical study of mechanisms and kinetics of reactions of the O(3P) atom with alkyl hydroperoxides (ROOH) where (R=CH3 & C2H5)

2021 ◽  
pp. 113547
Author(s):  
Kanika Guleria ◽  
Ranga Subramanian
Keyword(s):  
Theoretical Study ◽  
Alkyl Hydroperoxides ◽  
Kinetics Of

Single atom catalysts supported on N-doped graphene toward fast kinetic Li−S batteries: a theoretical study

2021 ◽  
Author(s):  
Xu Han ◽  
Zeyun Zhang ◽  
Xuefei Xu
Keyword(s):  
Theoretical Study ◽  
Single Atom ◽  
Discharge Process ◽  
Fast Kinetics ◽  
Shuttle Effect ◽  
Sufficient Stability ◽  
Doped Graphene ◽  
Fast Kinetic ◽  
Kinetics Of ◽  
Charge Discharge

To suppress the shuttle effect of lithium polysulfides and promote fast kinetics of charge−discharge process in Li−S batteries, it is essential to search promising catalysts with sufficient stability and high...

Theoretical study of the mechanisms for the homogenous gas-phase elimination kinetics of some 2-hydroxynitroalkanes

2006 ◽  
Vol 19 (12) ◽  
pp. 836-840 ◽  
Author(s):  
Rafael Añez ◽  
Rodolfo Izquierdo ◽  
Alba Vidal ◽  
Tania Cordova ◽  
Aníbal Sierraalta ◽  
...  
Keyword(s):  
Gas Phase ◽  
Theoretical Study ◽  
Elimination Kinetics ◽  
Kinetics Of ◽  
Phase Elimination

scholarly journals Kinetics of cluster growth in polar solutions of fullerene: Experimental and theoretical study of C60/NMP solution

2012 ◽  
Vol 175 ◽  
pp. 4-11 ◽  
Author(s):  
T.V. Tropin ◽  
N. Jargalan ◽  
M.V. Avdeev ◽  
O.A. Kyzyma ◽  
R.A. Eremin ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Cluster Growth ◽  
Kinetics Of ◽  
Polar Solutions

A Combined Experimental and Theoretical Study of the Homogeneous, Unimolecular Decomposition Kinetics of 3-Chloropivalic Acid in the Gas Phase

2001 ◽  
Vol 105 (10) ◽  
pp. 1869-1875 ◽  
Author(s):  
Gabriel Chuchani ◽  
Alexandra Rotinov ◽  
Juan Andrés ◽  
Luís R. Domingo ◽  
V. Sixte Safont
Keyword(s):  
Gas Phase ◽  
Theoretical Study ◽  
Decomposition Kinetics ◽  
Unimolecular Decomposition ◽  
Kinetics Of

Kinetics of Triscarbonato Uranyl Reduction by Aqueous Ferrous Iron:  A Theoretical Study

2006 ◽  
Vol 110 (31) ◽  
pp. 9691-9701 ◽  
Author(s):  
Matthew C. F. Wander ◽  
Sebastien Kerisit ◽  
Kevin M. Rosso ◽  
Martin A. A. Schoonen
Keyword(s):  
Ferrous Iron ◽  
Theoretical Study ◽  
Kinetics Of

scholarly journals Theoretical Study of the Ti–Cl Bond Cleavage Reaction in TiCl4

2017 ◽  
Vol 231 (9) ◽  
Author(s):  
Daniel Nurkowski ◽  
Ahren W. Jasper ◽  
Jethro Akroyd ◽  
Markus Kraft
Keyword(s):  
Theoretical Study ◽  
Bond Cleavage ◽  
Cleavage Reaction ◽  
Bond Cleavage Reaction ◽  
Kinetics Of

AbstractIn this work the kinetics of the TiCl

An experimental and theoretical study of the kinetics of the reaction between 3-hydroxy-3-methyl-2-butanone and OH radicals

RSC Advances ◽  
2015 ◽  
Vol 5 (34) ◽  
pp. 26559-26568 ◽  
Author(s):  
Angappan Mano Priya ◽  
Gisèle El Dib ◽  
Lakshmipathi Senthilkumar ◽  
Chantal Sleiman ◽  
Alexandre Tomas ◽  
...  
Keyword(s):  
Rate Constants ◽  
Theoretical Study ◽  
Oh Radicals ◽  
First Time ◽  
Kinetics Of

Absolute experimental and theoretical rate constants are determined for the first time for the reaction of 3-hydroxy-3-methyl-2-butanone with OH as a function of temperature. The atmospheric implications are discussed.

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