Investigation of the Reaction Mechanism and Kinetics of Iodic Acid with OH Radical Using Quantum Chemistry

2017 ◽  
Vol 1 (4) ◽  
pp. 227-235 ◽  
Author(s):  
Sarah Khanniche ◽  
Florent Louis ◽  
Laurent Cantrel ◽  
Ivan Černušák
Keyword(s):  
Reaction Mechanism ◽  
Quantum Chemistry ◽  
Oh Radical ◽  
Iodic Acid ◽  
Mechanism And Kinetics ◽  
Kinetics Of

scholarly journals Atmospheric chemical reaction mechanism and kinetics of 1,2-bis(2,4,6-tribromophenoxy)ethane initiated by OH radical: a computational study

RSC Advances ◽  
2017 ◽  
Vol 7 (16) ◽  
pp. 9484-9494 ◽  
Author(s):  
Qi Yu ◽  
Hong-Bin Xie ◽  
Tianchi Li ◽  
Fangfang Ma ◽  
Zihao Fu ◽  
...  
Keyword(s):  
Reaction Mechanism ◽  
Chemical Reaction ◽  
Computational Study ◽  
Oh Radical ◽  
Chemical Reaction Mechanism ◽  
Mechanism And Kinetics ◽  
Kinetics Of

The mechanism and kinetics of OH-initiated oxidation of BTBPE, an alternative of PBDEs, were investigated.

Theoretical study on the reaction mechanism of OH radical with Z(E)-CF3CHCHF

2019 ◽  
Vol 21 (3) ◽  
pp. 1367-1374 ◽  
Author(s):  
Chao Xu ◽  
Chaoyang Wang ◽  
Bo Li ◽  
Linping Hu ◽  
Feng Long Gu
Keyword(s):  
Reaction Mechanism ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Theoretical Study ◽  
Oh Radicals ◽  
Oh Radical ◽  
Transformation Mechanism ◽  
Mechanism And Kinetics ◽  
Kinetics Of

The comprehensive transformation mechanism and kinetics of Z(E)-CF3CHCHF initiated by OH radicals were investigated by performing quantum chemical calculations.

Mechanism and Kinetics of the Reaction of OH Radicals with Glyoxal and Methylglyoxal: A Quantum Chemistry+CVT/SCT Approach

ChemPhysChem ◽  
2004 ◽  
Vol 5 (9) ◽  
pp. 1379-1388 ◽  
Author(s):  
Annia Galano ◽  
J. Raúl Alvarez-Idaboy ◽  
Ma. Esther Ruiz-Santoyo ◽  
Annik Vivier-Bunge
Keyword(s):  
Quantum Chemistry ◽  
Oh Radicals ◽  
Mechanism And Kinetics ◽  
Kinetics Of

Quantum chemistry and TST study of the mechanism and kinetics of the butadiene and isoprene reactions with mercapto radicals

2008 ◽  
Vol 344 (3) ◽  
pp. 273-280 ◽  
Author(s):  
Misaela Francisco-Márquez ◽  
J. Raul Alvarez-Idaboy ◽  
Annia Galano ◽  
Annik Vivier-Bunge
Keyword(s):  
Quantum Chemistry ◽  
Mechanism And Kinetics ◽  
Kinetics Of
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