Quantum chemical investigation on the mechanism and kinetics of OH radical-initiated atmospheric oxidation of PCB-47

Chemosphere ◽  
2015 ◽  
Vol 133 ◽  
pp. 53-60 ◽  
Author(s):  
Yanhui Sun ◽  
Qingzhu Zhang ◽  
Hui Wang ◽  
Wenxing Wang
Keyword(s):  
Quantum Chemical ◽  
Chemical Investigation ◽  
Atmospheric Oxidation ◽  
Oh Radical ◽  
Quantum Chemical Investigation ◽  
Mechanism And Kinetics ◽  
Kinetics Of

Quantum Chemical Investigation on the Mechanism and Kinetics of PBDE Photooxidation by ·OH: A Case Study for BDE-15

2011 ◽  
Vol 45 (11) ◽  
pp. 4839-4845 ◽  
Author(s):  
Jing Zhou ◽  
Jingwen Chen ◽  
Chi-Hsiu Liang ◽  
Qing Xie ◽  
Ya-Nan Wang ◽  
...  
Keyword(s):  
Quantum Chemical ◽  
Chemical Investigation ◽  
Quantum Chemical Investigation ◽  
Mechanism And Kinetics ◽  
Kinetics Of

Products, mechanism, and kinetics of OH radical-initiated oxidation degradation of 2,4,4′-trichlorobiphenyl in the atmosphere

RSC Advances ◽  
2016 ◽  
Vol 6 (66) ◽  
pp. 61794-61802 ◽  
Author(s):  
Yanhui Sun ◽  
Qingzhu Zhang ◽  
Wenxing Wang
Keyword(s):  
Polychlorinated Biphenyls ◽  
Oxidation Mechanism ◽  
Oxidation Products ◽  
Atmospheric Oxidation ◽  
Kinetic Properties ◽  
Oh Radical ◽  
Crucial Importance ◽  
Mechanism And Kinetics ◽  
Oxidation Degradation ◽  
Kinetics Of

To better understand the behavior, fate and oxidation products of polychlorinated biphenyls (PCBs) in the atmosphere, probing the atmospheric oxidation mechanism and kinetic properties of PCBs is of crucial importance.

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.

Photo-redox coupled Co-pincer complexes for efficient decarbonylation of aryl carbonyls: A quantum chemical investigation

2021 ◽  
Vol 507 ◽  
pp. 111553
Author(s):  
Animesh Chowdhury ◽  
Santu Biswas ◽  
Sourav Ghoshal ◽  
Anup Pramanik ◽  
Pranab Sarkar
Keyword(s):  
Quantum Chemical ◽  
Chemical Investigation ◽  
Pincer Complexes ◽  
Quantum Chemical Investigation
Sign in / Sign up

Export Citation Format

Share Document