Kinetics and degradation mechanism of atmospheric isoprene (2‐methyl‐1, 3‐butadiene ( C 5 H 8 )) with chlorine radical and its derivatives—A theoretical study

2020 ◽  
Author(s):  
Mohanapriya Subramani ◽  
Akilan Rajamani ◽  
Ramasamy Shankar
Keyword(s):  
Theoretical Study ◽  
Degradation Mechanism

Adsorption characteristics and degradation mechanism of metronidazole on the surface of photocatalyst TiO2: A theoretical study

2019 ◽  
Vol 478 ◽  
pp. 896-905 ◽  
Author(s):  
Danyang Wang ◽  
Hui Luo ◽  
Liuxie Liu ◽  
Wei Wei ◽  
Laicai Li
Keyword(s):  
Theoretical Study ◽  
Degradation Mechanism ◽  
Adsorption Characteristics

scholarly journals Adsorption characteristics and degradation mechanism of DMZ on photocatalyst TiO<sub>2</sub> surface: a density functional theoretical study

2018 ◽  
Vol 49 (2) ◽  
pp. 368-379
Author(s):  
Bohua Xu ◽  
Fulan Zhang ◽  
Wei Wei ◽  
Xiao Chen ◽  
Laicai Li ◽  
...  
Keyword(s):  
Density Functional ◽  
Theoretical Study ◽  
Degradation Mechanism ◽  
Adsorption Characteristics

Atmospheric degradation mechanism of benzyl peroxy radical: A theoretical study

2019 ◽  
Vol 201 ◽  
pp. 18-27 ◽  
Author(s):  
Bo Feng ◽  
Cuihong Sun ◽  
Shaowen Zhang
Keyword(s):  
Theoretical Study ◽  
Degradation Mechanism ◽  
Peroxy Radical ◽  
Atmospheric Degradation

Theoretical study on the degradation mechanism of carbamate pesticides with OH radicals

2015 ◽  
Vol 134 (3) ◽  
Author(s):  
Shengmin Sun ◽  
Kun Zhang ◽  
Hui Zhang
Keyword(s):  
Theoretical Study ◽  
Degradation Mechanism ◽  
Oh Radicals ◽  
Carbamate Pesticides

Theoretical study on the adsorption and catalytic degradation mechanism of sulfacetamide on anatase TiO2(001) and (101) surfaces

2021 ◽  
Vol 45 (6) ◽  
pp. 3234-3241
Author(s):  
Kai Li ◽  
Jing Tang ◽  
Yang He ◽  
Jianmin Guo ◽  
Laicai Li
Keyword(s):  
Titanium Dioxide ◽  
Theoretical Study ◽  
Degradation Mechanism ◽  
Catalytic Degradation ◽  
Anatase Tio2 ◽  
Degradation Pathways

In this paper, the adsorption of sulfacetamide on anatase titanium dioxide (001) and (101) was studied. The mechanism of six degradation pathways of sulfacetamide was discussed.

Theoretical study on the degradation mechanism of methamidophos and chloramine phosphorus with OH radicals

2015 ◽  
Vol 115 (17) ◽  
pp. 1187-1193 ◽  
Author(s):  
Shengmin Sun ◽  
Kun Zhang ◽  
Yang Lu ◽  
Ping Liu ◽  
Hui Zhang
Keyword(s):  
Theoretical Study ◽  
Degradation Mechanism ◽  
Oh Radicals

scholarly journals Theoretical study on the atmospheric degradation mechanism and subsequent products of E,E‐2,4‐hexadienal with hydroxyl radical

2020 ◽  
Author(s):  
Yanan Sun ◽  
Junfang Yao ◽  
Yizhen Tang ◽  
Yunju Zhang ◽  
Wenzhong Wu ◽  
...  
Keyword(s):  
Hydroxyl Radical ◽  
Theoretical Study ◽  
Degradation Mechanism ◽  
Atmospheric Degradation

scholarly journals Theoretical study on the atmospheric degradation mechanism and subsequent products of E,E-2,4-hexadienal with hydroxyl radical

2020 ◽  
Author(s):  
Yanan Sun ◽  
Junfang Yao ◽  
Yizhen Tang ◽  
yunju zhang ◽  
Wenzhong Wu ◽  
...  
Keyword(s):  
Hydroxyl Radical ◽  
Theoretical Study ◽  
Degradation Mechanism ◽  
Atmospheric Degradation
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